Exact Mass: 311.1845

Exact Mass Matches: 311.1845

Found 500 metabolites which its exact mass value is equals to given mass value 311.1845, within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error 0.01 dalton.

Leonurine

Benzoic acid, 4-hydroxy-3,5-dimethoxy-, 4-((aminoiminomethyl)amino)butyl ester

C14H21N3O5 (311.1481)


Leonurine is a trihydroxybenzoic acid. Leonurine is a natural product found in Leonotis leonurus and Leonurus sibiricus with data available. Leonurine is an alkaloid isolated from Leonurus artemisia, with anti-oxidative and anti-inflammatory. Leonurine is an alkaloid isolated from Leonurus artemisia, with anti-oxidative and anti-inflammatory.

   

Biperiden

1-{bicyclo[2.2.1]hept-5-en-2-yl}-1-phenyl-3-(piperidin-1-yl)propan-1-ol

C21H29NO (311.2249)


A muscarinic antagonist that has effects in both the central and peripheral nervous systems. It has been used in the treatment of arteriosclerotic, idiopathic, and postencephalitic parkinsonism. It has also been used to alleviate extrapyramidal symptoms induced by phenothiazine derivatives and reserpine. [PubChem] D002491 - Central Nervous System Agents > D018726 - Anti-Dyskinesia Agents > D000978 - Antiparkinson Agents N - Nervous system > N04 - Anti-parkinson drugs > N04A - Anticholinergic agents > N04AA - Tertiary amines C78272 - Agent Affecting Nervous System > C66880 - Anticholinergic Agent > C29704 - Antimuscarinic Agent D018373 - Peripheral Nervous System Agents > D001337 - Autonomic Agents > D010276 - Parasympatholytics D018377 - Neurotransmitter Agents > D018678 - Cholinergic Agents > D018680 - Cholinergic Antagonists C78272 - Agent Affecting Nervous System > C38149 - Antiparkinsonian Agent Biperiden (KL 373) is a non-selective muscarinic receptor antagonist that competitively binds to M1 muscarinic receptors, thereby inhibiting acetylcholine and enhancing dopamine signaling in the central nervous system. Biperiden has the potential for the research of Parkinson's disease and other related psychiatric disorders[1][2].

   

Pretilachlor

2-chloro-N-(2,6-diethylphenyl)-N-(2-propoxyethyl)acetamide

C17H26ClNO2 (311.1652)


CONFIDENCE standard compound; EAWAG_UCHEM_ID 3117

   

nalorphine

nalorphine

C19H21NO3 (311.1521)


V - Various > V03 - All other therapeutic products > V03A - All other therapeutic products > V03AB - Antidotes D002492 - Central Nervous System Depressants > D009294 - Narcotics > D053610 - Opiate Alkaloids D018373 - Peripheral Nervous System Agents > D018689 - Sensory System Agents C78272 - Agent Affecting Nervous System > C67413 - Opioid Receptor Agonist D002491 - Central Nervous System Agents > D009292 - Narcotic Antagonists

   

(-)-Thebaine

10,14-dimethoxy-4-methyl-12-oxa-4-azapentacyclo[9.6.1.0¹,¹³.0⁵,¹⁷.0⁷,¹⁸]octadeca-7(18),8,10,14,16-pentaene

C19H21NO3 (311.1521)


D002491 - Central Nervous System Agents > D000697 - Central Nervous System Stimulants > D003292 - Convulsants D002491 - Central Nervous System Agents > D002492 - Central Nervous System Depressants > D009294 - Narcotics D002492 - Central Nervous System Depressants > D009294 - Narcotics > D053610 - Opiate Alkaloids C78272 - Agent Affecting Nervous System > C67413 - Opioid Receptor Agonist > C1657 - Opiate D018373 - Peripheral Nervous System Agents > D018689 - Sensory System Agents D002491 - Central Nervous System Agents > D000700 - Analgesics (-)-Thebaine is a minor constituent of opiu

   

Machete

N-(butoxymethyl)-2-chloro-N-(2,6-diethylphenyl)acetamide

C17H26ClNO2 (311.1652)


CONFIDENCE standard compound; INTERNAL_ID 560; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 10349; ORIGINAL_PRECURSOR_SCAN_NO 10345 CONFIDENCE standard compound; INTERNAL_ID 560; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 10330; ORIGINAL_PRECURSOR_SCAN_NO 10326 CONFIDENCE standard compound; INTERNAL_ID 560; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 10216; ORIGINAL_PRECURSOR_SCAN_NO 10211 CONFIDENCE standard compound; INTERNAL_ID 560; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 10284; ORIGINAL_PRECURSOR_SCAN_NO 10281 CONFIDENCE standard compound; INTERNAL_ID 560; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 10304; ORIGINAL_PRECURSOR_SCAN_NO 10299 CONFIDENCE standard compound; INTERNAL_ID 560; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 10247; ORIGINAL_PRECURSOR_SCAN_NO 10245 D010575 - Pesticides > D006540 - Herbicides D009676 - Noxae > D002273 - Carcinogens D016573 - Agrochemicals

   

Spiradine A

6-Hydroxyhetisan-11-one

C20H25NO2 (311.1885)


   

Isothebaine

4H-Dibenzo[de,g]quinolin-1-ol,5,6,6a,7-tetrahydro-2,11-dimethoxy-6-methyl-, (6aS)-

C19H21NO3 (311.1521)


   

(R)-Pronuciferine

10,11-dimethoxy-5-methyl-5-azaspiro[cyclohexane-1,2-tricyclo[6.3.1.0⁴,¹²]dodecane]-1(12),2,5,8,10-pentaen-4-one

C19H21NO3 (311.1521)


Alkaloid from Nelumbo nucifera (East India lotus). (R)-Pronuciferine is found in many foods, some of which are poppy, coffee and coffee products, sacred lotus, and cherimoya. (R)-Pronuciferine is found in cherimoya. (R)-Pronuciferine is an alkaloid from Nelumbo nucifera (East India lotus

   
   

17beta-Hydroxy-3-methoxyestra-1,3,5(10)-triene-17-carbonitrile

17beta-Hydroxy-3-methoxyestra-1,3,5(10)-triene-17-carbonitrile

C20H25NO2 (311.1885)


   
   

1-[(1R,4R)-5-bicyclo[2.2.1]hept-2-enyl]-1-phenyl-3-(1-piperidinyl)-1-propanol

1-[(1R,4R)-5-bicyclo[2.2.1]hept-2-enyl]-1-phenyl-3-(1-piperidinyl)-1-propanol

C21H29NO (311.2249)


   

N-[2-Methoxy-2-(4-methoxyphenyl)ethyl]cinnamide

(2E)-N-[2-Methoxy-2-(4-methoxyphenyl)ethyl]-3-phenylprop-2-enimidate

C19H21NO3 (311.1521)


N-[2-Methoxy-2-(4-methoxyphenyl)ethyl]cinnamide is found in fruits. N-[2-Methoxy-2-(4-methoxyphenyl)ethyl]cinnamide is isolated from Aegle marmelos (bael). Isolated from Aegle marmelos (bael). N-[2-Methoxy-2-(4-methoxyphenyl)ethyl]cinnamide is found in fruits.

   

Piperettine

(2E,4E,6E)-7-(2H-1,3-benzodioxol-5-yl)-1-(piperidin-1-yl)hepta-2,4,6-trien-1-one

C19H21NO3 (311.1521)


Alkaloid from the dried fruits of Piper nigrum (pepper). Piperettine is found in herbs and spices and pepper (spice). Piperettine is found in herbs and spices. Piperettine is an alkaloid from the dried fruits of Piper nigrum (pepper

   

Lansamide 4

3-Hydroxy-6-methoxy-1-methyl-4,5-diphenyl-2-piperidinone

C19H21NO3 (311.1521)


Lansamide 4 is found in fruits. Lansamide 4 is a constituent of Clausena lansium (wampee) Constituent of Clausena lansium (wampee). Lansamide 4 is found in fruits.

   

Arginylhistidine

(2S)-2-{[(2S)-2-amino-5-carbamimidamido-1-hydroxypentylidene]amino}-3-(1H-imidazol-5-yl)propanoate

C12H21N7O3 (311.1706)


Arginylhistidine is a dipeptide composed of arginine and histidine. It is an incomplete breakdown product of protein digestion or protein catabolism. Some dipeptides are known to have physiological or cell-signaling effects although most are simply short-lived intermediates on their way to specific amino acid degradation pathways following further proteolysis.

   

Histidylarginine

(2S)-2-[(2S)-2-amino-3-(3H-imidazol-4-yl)propanamido]-5-carbamimidamidopentanoic acid

C12H21N7O3 (311.1706)


Histidylarginine is a dipeptide composed of histidine and arginine. It is an incomplete breakdown product of protein digestion or protein catabolism. Dipeptides are organic compounds containing a sequence of exactly two alpha-amino acids joined by a peptide bond. Some dipeptides are known to have physiological or cell-signalling effects although most are simply short-lived intermediates on their way to specific amino acid degradation pathways following further proteolysis.

   

2-trans,4-cis-Decadienoylcarnitine

(3R)-3-[(2E,4Z)-Deca-2,4-dienoyloxy]-4-(trimethylazaniumyl)butanoic acid

C17H29NO4 (311.2096)


2-trans,4-cis-Decadienoylcarnitine is an acylcarnitine. More specifically, it is an (2E,4Z)-deca-2,4-dienoic acid ester of carnitine. Acylcarnitines were first discovered more than 70 year ago (PMID: 13825279). It is believed that there are more than 1000 types of acylcarnitines in the human body. The general role of acylcarnitines is to transport acyl-groups (organic acids and fatty acids) from the cytoplasm into the mitochondria so that they can be broken down to produce energy.  This process is known as beta-oxidation. According to a recent review [Dambrova et al. 2021, Physiological Reviews], acylcarnitines (ACs) can be classified into 9 different categories depending on the type and size of their acyl-group: 1) short-chain ACs; 2) medium-chain ACs; 3) long-chain ACs; 4) very long-chain ACs; 5) hydroxy ACs; 6) branched chain ACs; 7) unsaturated ACs; 8) dicarboxylic ACs and 9) miscellaneous ACs. Short-chain ACs have acyl-groups with two to five carbons (C2-C5), medium-chain ACs have acyl-groups with six to thirteen carbons (C6-C13), long-chain ACs have acyl-groups with fourteen to twenty once carbons (C14-C21) and very long-chain ACs have acyl groups with more than 22 carbons. 2-trans,4-cis-Decadienoylcarnitine is therefore classified as a medium chain AC. As a medium-chain acylcarnitine 2-trans,4-cis-decadienoylcarnitine is somewhat less abundant than short-chain acylcarnitines. These are formed either through esterification with L-carnitine or through the peroxisomal metabolism of longer chain acylcarnitines (PMID: 30540494). Many medium-chain acylcarnitines can serve as useful markers for inherited disorders of fatty acid metabolism. In particular 2-trans,4-cis-decadienoylcarnitine is elevated in the blood or plasma of individuals with 2,4-dienoyl-coenzyme a reductase deficiency (PMID: 2332510, PMID: 15344554, PMID: 19578400). It is also decreased in the blood or plasma of individuals with familial mediterranean fever (PMID: 29900937) and schizophrenia (PMID: 31161852). Carnitine octanoyltransferase (CrOT, EC:2.3.1.137) is responsible for the synthesis of all medium-chain (MCAC, C5-C12) and medium-length branched-chain acylcarnitines in peroxisomes (PMID: 10486279). The study of acylcarnitines is an active area of research and it is likely that many novel acylcarnitines will be discovered in the coming years. It is also likely that many novel roles in health and disease will be uncovered. An excellent review of the current state of knowledge for acylcarnitines is available at [Dambrova et al. 2021, Physiological Reviews]. A human metabolite taken as a putative food compound of mammalian origin [HMDB]

   

Lansimide 3

3-hydroxy-5-[methoxy(phenyl)methyl]-1-methyl-4-phenylpyrrolidin-2-one

C19H21NO3 (311.1521)


Lansimide 3 is found in fruits. Lansimide 3 is a constituent of Clausena lansium (wampee)

   

Pyrrobutamine

1-[(2E)-4-(4-chlorophenyl)-3-phenylbut-2-en-1-yl]pyrrolidine

C20H22ClN (311.1441)


R - Respiratory system > R06 - Antihistamines for systemic use > R06A - Antihistamines for systemic use Pyrrobutamine is an H1-antihistamine.

   

(2E,4Z)-Decadienoylcarnitine

3-[(2E,4Z)-Deca-2,4-dienoyloxy]-4-(trimethylammonio)butanoic acid

C17H29NO4 (311.2096)


(2E,4Z)-Decadienoylcarnitine is an acylcarnitine. More specifically, it is an (2E,4Z)-decadienoic acid ester of carnitine. Acylcarnitines were first discovered more than 70 year ago (PMID: 13825279). It is believed that there are more than 1000 types of acylcarnitines in the human body. The general role of acylcarnitines is to transport acyl-groups (organic acids and fatty acids) from the cytoplasm into the mitochondria so that they can be broken down to produce energy. This process is known as beta-oxidation. According to a recent review [Dambrova et al. 2021, Physiological Reviews], acylcarnitines (ACs) can be classified into 9 different categories depending on the type and size of their acyl-group: 1) short-chain ACs; 2) medium-chain ACs; 3) long-chain ACs; 4) very long-chain ACs; 5) hydroxy ACs; 6) branched chain ACs; 7) unsaturated ACs; 8) dicarboxylic ACs and 9) miscellaneous ACs. Short-chain ACs have acyl-groups with two to five carbons (C2-C5), medium-chain ACs have acyl-groups with six to thirteen carbons (C6-C13), long-chain ACs have acyl-groups with fourteen to twenty once carbons (C14-C21) and very long-chain ACs have acyl groups with more than 22 carbons. (2E,4Z)-Decadienoylcarnitine is therefore classified as a medium chain AC. As a medium-chain acylcarnitine (2E,4Z)-Decadienoylcarnitine is somewhat less abundant than short-chain acylcarnitines. These are formed either through esterification with L-carnitine or through the peroxisomal metabolism of longer chain acylcarnitines (PMID: 30540494). Many medium-chain acylcarnitines can serve as useful markers for inherited disorders of fatty acid metabolism. In particular (2E,4Z)-Decadienoylcarnitine is elevated in the blood or plasma of individuals with 2,4-dienoyl-coenzyme a reductase deficiency (PMID: 2332510, PMID: 15344554, PMID: 19578400). It is also decreased in the blood or plasma of individuals with familial mediterranean fever (PMID: 29900937) and schizophrenia (PMID: 31161852). Carnitine octanoyltransferase (CrOT, EC:2.3.1.137) is responsible for the synthesis of all medium-chain (MCAC, C5-C12) and medium-length branched-chain acylcarnitines in peroxisomes (PMID: 10486279). The study of acylcarnitines is an active area of research and it is likely that many novel acylcarnitines will be discovered in the coming years. It is also likely that many novel roles in health and disease will be uncovered. An excellent review of the current state of knowledge for acylcarnitines is available at [Dambrova et al. 2021, Physiological Reviews].

   

(3,8)-Decadienoylcarnitine

3-(deca-3,8-dienoyloxy)-4-(trimethylazaniumyl)butanoate

C17H29NO4 (311.2096)


(3,8)-Decadienoylcarnitine is an acylcarnitine. More specifically, it is an deca-3,8-dienoic acid ester of carnitine. Acylcarnitines were first discovered more than 70 year ago (PMID: 13825279). It is believed that there are more than 1000 types of acylcarnitines in the human body. The general role of acylcarnitines is to transport acyl-groups (organic acids and fatty acids) from the cytoplasm into the mitochondria so that they can be broken down to produce energy. This process is known as beta-oxidation. According to a recent review [Dambrova et al. 2021, Physiological Reviews], acylcarnitines (ACs) can be classified into 9 different categories depending on the type and size of their acyl-group: 1) short-chain ACs; 2) medium-chain ACs; 3) long-chain ACs; 4) very long-chain ACs; 5) hydroxy ACs; 6) branched chain ACs; 7) unsaturated ACs; 8) dicarboxylic ACs and 9) miscellaneous ACs. Short-chain ACs have acyl-groups with two to five carbons (C2-C5), medium-chain ACs have acyl-groups with six to thirteen carbons (C6-C13), long-chain ACs have acyl-groups with fourteen to twenty once carbons (C14-C21) and very long-chain ACs have acyl groups with more than 22 carbons. (3,8)-Decadienoylcarnitine is therefore classified as a medium chain AC. As a medium-chain acylcarnitine (3,8)-Decadienoylcarnitine is somewhat less abundant than short-chain acylcarnitines. These are formed either through esterification with L-carnitine or through the peroxisomal metabolism of longer chain acylcarnitines (PMID: 30540494). Many medium-chain acylcarnitines can serve as useful markers for inherited disorders of fatty acid metabolism. In particular (3,8)-Decadienoylcarnitine is elevated in the blood or plasma of individuals with 2,4-dienoyl-coenzyme a reductase deficiency (PMID: 2332510, PMID: 15344554, PMID: 19578400). It is also decreased in the blood or plasma of individuals with familial mediterranean fever (PMID: 29900937) and schizophrenia (PMID: 31161852). Carnitine octanoyltransferase (CrOT, EC:2.3.1.137) is responsible for the synthesis of all medium-chain (MCAC, C5-C12) and medium-length branched-chain acylcarnitines in peroxisomes (PMID: 10486279). The study of acylcarnitines is an active area of research and it is likely that many novel acylcarnitines will be discovered in the coming years. It is also likely that many novel roles in health and disease will be uncovered. An excellent review of the current state of knowledge for acylcarnitines is available at [Dambrova et al. 2021, Physiological Reviews].

   

(2,6)-Decadienoylcarnitine

3-(deca-2,6-dienoyloxy)-4-(trimethylazaniumyl)butanoate

C17H29NO4 (311.2096)


(2,6)-Decadienoylcarnitine is an acylcarnitine. More specifically, it is an deca-2,6-dienoic acid ester of carnitine. Acylcarnitines were first discovered more than 70 year ago (PMID: 13825279). It is believed that there are more than 1000 types of acylcarnitines in the human body. The general role of acylcarnitines is to transport acyl-groups (organic acids and fatty acids) from the cytoplasm into the mitochondria so that they can be broken down to produce energy. This process is known as beta-oxidation. According to a recent review [Dambrova et al. 2021, Physiological Reviews], acylcarnitines (ACs) can be classified into 9 different categories depending on the type and size of their acyl-group: 1) short-chain ACs; 2) medium-chain ACs; 3) long-chain ACs; 4) very long-chain ACs; 5) hydroxy ACs; 6) branched chain ACs; 7) unsaturated ACs; 8) dicarboxylic ACs and 9) miscellaneous ACs. Short-chain ACs have acyl-groups with two to five carbons (C2-C5), medium-chain ACs have acyl-groups with six to thirteen carbons (C6-C13), long-chain ACs have acyl-groups with fourteen to twenty once carbons (C14-C21) and very long-chain ACs have acyl groups with more than 22 carbons. (2,6)-Decadienoylcarnitine is therefore classified as a medium chain AC. As a medium-chain acylcarnitine (2,6)-Decadienoylcarnitine is somewhat less abundant than short-chain acylcarnitines. These are formed either through esterification with L-carnitine or through the peroxisomal metabolism of longer chain acylcarnitines (PMID: 30540494). Many medium-chain acylcarnitines can serve as useful markers for inherited disorders of fatty acid metabolism. In particular (2,6)-Decadienoylcarnitine is elevated in the blood or plasma of individuals with 2,4-dienoyl-coenzyme a reductase deficiency (PMID: 2332510, PMID: 15344554, PMID: 19578400). It is also decreased in the blood or plasma of individuals with familial mediterranean fever (PMID: 29900937) and schizophrenia (PMID: 31161852). Carnitine octanoyltransferase (CrOT, EC:2.3.1.137) is responsible for the synthesis of all medium-chain (MCAC, C5-C12) and medium-length branched-chain acylcarnitines in peroxisomes (PMID: 10486279). The study of acylcarnitines is an active area of research and it is likely that many novel acylcarnitines will be discovered in the coming years. It is also likely that many novel roles in health and disease will be uncovered. An excellent review of the current state of knowledge for acylcarnitines is available at [Dambrova et al. 2021, Physiological Reviews].

   

(3,6)-Decadienoylcarnitine

3-(deca-3,6-dienoyloxy)-4-(trimethylazaniumyl)butanoate

C17H29NO4 (311.2096)


(3,6)-Decadienoylcarnitine is an acylcarnitine. More specifically, it is an deca-3,6-dienoic acid ester of carnitine. Acylcarnitines were first discovered more than 70 year ago (PMID: 13825279). It is believed that there are more than 1000 types of acylcarnitines in the human body. The general role of acylcarnitines is to transport acyl-groups (organic acids and fatty acids) from the cytoplasm into the mitochondria so that they can be broken down to produce energy. This process is known as beta-oxidation. According to a recent review [Dambrova et al. 2021, Physiological Reviews], acylcarnitines (ACs) can be classified into 9 different categories depending on the type and size of their acyl-group: 1) short-chain ACs; 2) medium-chain ACs; 3) long-chain ACs; 4) very long-chain ACs; 5) hydroxy ACs; 6) branched chain ACs; 7) unsaturated ACs; 8) dicarboxylic ACs and 9) miscellaneous ACs. Short-chain ACs have acyl-groups with two to five carbons (C2-C5), medium-chain ACs have acyl-groups with six to thirteen carbons (C6-C13), long-chain ACs have acyl-groups with fourteen to twenty once carbons (C14-C21) and very long-chain ACs have acyl groups with more than 22 carbons. (3,6)-Decadienoylcarnitine is therefore classified as a medium chain AC. As a medium-chain acylcarnitine (3,6)-Decadienoylcarnitine is somewhat less abundant than short-chain acylcarnitines. These are formed either through esterification with L-carnitine or through the peroxisomal metabolism of longer chain acylcarnitines (PMID: 30540494). Many medium-chain acylcarnitines can serve as useful markers for inherited disorders of fatty acid metabolism. In particular (3,6)-Decadienoylcarnitine is elevated in the blood or plasma of individuals with 2,4-dienoyl-coenzyme a reductase deficiency (PMID: 2332510, PMID: 15344554, PMID: 19578400). It is also decreased in the blood or plasma of individuals with familial mediterranean fever (PMID: 29900937) and schizophrenia (PMID: 31161852). Carnitine octanoyltransferase (CrOT, EC:2.3.1.137) is responsible for the synthesis of all medium-chain (MCAC, C5-C12) and medium-length branched-chain acylcarnitines in peroxisomes (PMID: 10486279). The study of acylcarnitines is an active area of research and it is likely that many novel acylcarnitines will be discovered in the coming years. It is also likely that many novel roles in health and disease will be uncovered. An excellent review of the current state of knowledge for acylcarnitines is available at [Dambrova et al. 2021, Physiological Reviews].

   

(6,8)-Decadienoylcarnitine

3-(deca-6,8-dienoyloxy)-4-(trimethylazaniumyl)butanoate

C17H29NO4 (311.2096)


(6,8)-Decadienoylcarnitine is an acylcarnitine. More specifically, it is an deca-6,8-dienoic acid ester of carnitine. Acylcarnitines were first discovered more than 70 year ago (PMID: 13825279). It is believed that there are more than 1000 types of acylcarnitines in the human body. The general role of acylcarnitines is to transport acyl-groups (organic acids and fatty acids) from the cytoplasm into the mitochondria so that they can be broken down to produce energy. This process is known as beta-oxidation. According to a recent review [Dambrova et al. 2021, Physiological Reviews], acylcarnitines (ACs) can be classified into 9 different categories depending on the type and size of their acyl-group: 1) short-chain ACs; 2) medium-chain ACs; 3) long-chain ACs; 4) very long-chain ACs; 5) hydroxy ACs; 6) branched chain ACs; 7) unsaturated ACs; 8) dicarboxylic ACs and 9) miscellaneous ACs. Short-chain ACs have acyl-groups with two to five carbons (C2-C5), medium-chain ACs have acyl-groups with six to thirteen carbons (C6-C13), long-chain ACs have acyl-groups with fourteen to twenty once carbons (C14-C21) and very long-chain ACs have acyl groups with more than 22 carbons. (6,8)-Decadienoylcarnitine is therefore classified as a medium chain AC. As a medium-chain acylcarnitine (6,8)-Decadienoylcarnitine is somewhat less abundant than short-chain acylcarnitines. These are formed either through esterification with L-carnitine or through the peroxisomal metabolism of longer chain acylcarnitines (PMID: 30540494). Many medium-chain acylcarnitines can serve as useful markers for inherited disorders of fatty acid metabolism. In particular (6,8)-Decadienoylcarnitine is elevated in the blood or plasma of individuals with 2,4-dienoyl-coenzyme a reductase deficiency (PMID: 2332510, PMID: 15344554, PMID: 19578400). It is also decreased in the blood or plasma of individuals with familial mediterranean fever (PMID: 29900937) and schizophrenia (PMID: 31161852). Carnitine octanoyltransferase (CrOT, EC:2.3.1.137) is responsible for the synthesis of all medium-chain (MCAC, C5-C12) and medium-length branched-chain acylcarnitines in peroxisomes (PMID: 10486279). The study of acylcarnitines is an active area of research and it is likely that many novel acylcarnitines will be discovered in the coming years. It is also likely that many novel roles in health and disease will be uncovered. An excellent review of the current state of knowledge for acylcarnitines is available at [Dambrova et al. 2021, Physiological Reviews].

   

(3,5)-Decadienoylcarnitine

3-(deca-3,5-dienoyloxy)-4-(trimethylazaniumyl)butanoate

C17H29NO4 (311.2096)


(3,5)-Decadienoylcarnitine is an acylcarnitine. More specifically, it is an deca-3,5-dienoic acid ester of carnitine. Acylcarnitines were first discovered more than 70 year ago (PMID: 13825279). It is believed that there are more than 1000 types of acylcarnitines in the human body. The general role of acylcarnitines is to transport acyl-groups (organic acids and fatty acids) from the cytoplasm into the mitochondria so that they can be broken down to produce energy. This process is known as beta-oxidation. According to a recent review [Dambrova et al. 2021, Physiological Reviews], acylcarnitines (ACs) can be classified into 9 different categories depending on the type and size of their acyl-group: 1) short-chain ACs; 2) medium-chain ACs; 3) long-chain ACs; 4) very long-chain ACs; 5) hydroxy ACs; 6) branched chain ACs; 7) unsaturated ACs; 8) dicarboxylic ACs and 9) miscellaneous ACs. Short-chain ACs have acyl-groups with two to five carbons (C2-C5), medium-chain ACs have acyl-groups with six to thirteen carbons (C6-C13), long-chain ACs have acyl-groups with fourteen to twenty once carbons (C14-C21) and very long-chain ACs have acyl groups with more than 22 carbons. (3,5)-Decadienoylcarnitine is therefore classified as a medium chain AC. As a medium-chain acylcarnitine (3,5)-Decadienoylcarnitine is somewhat less abundant than short-chain acylcarnitines. These are formed either through esterification with L-carnitine or through the peroxisomal metabolism of longer chain acylcarnitines (PMID: 30540494). Many medium-chain acylcarnitines can serve as useful markers for inherited disorders of fatty acid metabolism. In particular (3,5)-Decadienoylcarnitine is elevated in the blood or plasma of individuals with 2,4-dienoyl-coenzyme a reductase deficiency (PMID: 2332510, PMID: 15344554, PMID: 19578400). It is also decreased in the blood or plasma of individuals with familial mediterranean fever (PMID: 29900937) and schizophrenia (PMID: 31161852). Carnitine octanoyltransferase (CrOT, EC:2.3.1.137) is responsible for the synthesis of all medium-chain (MCAC, C5-C12) and medium-length branched-chain acylcarnitines in peroxisomes (PMID: 10486279). The study of acylcarnitines is an active area of research and it is likely that many novel acylcarnitines will be discovered in the coming years. It is also likely that many novel roles in health and disease will be uncovered. An excellent review of the current state of knowledge for acylcarnitines is available at [Dambrova et al. 2021, Physiological Reviews].

   

(2,8)-Decadienoylcarnitine

3-(deca-2,8-dienoyloxy)-4-(trimethylazaniumyl)butanoate

C17H29NO4 (311.2096)


(2,8)-Decadienoylcarnitine is an acylcarnitine. More specifically, it is an deca-2,8-dienoic acid ester of carnitine. Acylcarnitines were first discovered more than 70 year ago (PMID: 13825279). It is believed that there are more than 1000 types of acylcarnitines in the human body. The general role of acylcarnitines is to transport acyl-groups (organic acids and fatty acids) from the cytoplasm into the mitochondria so that they can be broken down to produce energy. This process is known as beta-oxidation. According to a recent review [Dambrova et al. 2021, Physiological Reviews], acylcarnitines (ACs) can be classified into 9 different categories depending on the type and size of their acyl-group: 1) short-chain ACs; 2) medium-chain ACs; 3) long-chain ACs; 4) very long-chain ACs; 5) hydroxy ACs; 6) branched chain ACs; 7) unsaturated ACs; 8) dicarboxylic ACs and 9) miscellaneous ACs. Short-chain ACs have acyl-groups with two to five carbons (C2-C5), medium-chain ACs have acyl-groups with six to thirteen carbons (C6-C13), long-chain ACs have acyl-groups with fourteen to twenty once carbons (C14-C21) and very long-chain ACs have acyl groups with more than 22 carbons. (2,8)-Decadienoylcarnitine is therefore classified as a medium chain AC. As a medium-chain acylcarnitine (2,8)-Decadienoylcarnitine is somewhat less abundant than short-chain acylcarnitines. These are formed either through esterification with L-carnitine or through the peroxisomal metabolism of longer chain acylcarnitines (PMID: 30540494). Many medium-chain acylcarnitines can serve as useful markers for inherited disorders of fatty acid metabolism. In particular (2,8)-Decadienoylcarnitine is elevated in the blood or plasma of individuals with 2,4-dienoyl-coenzyme a reductase deficiency (PMID: 2332510, PMID: 15344554, PMID: 19578400). It is also decreased in the blood or plasma of individuals with familial mediterranean fever (PMID: 29900937) and schizophrenia (PMID: 31161852). Carnitine octanoyltransferase (CrOT, EC:2.3.1.137) is responsible for the synthesis of all medium-chain (MCAC, C5-C12) and medium-length branched-chain acylcarnitines in peroxisomes (PMID: 10486279). The study of acylcarnitines is an active area of research and it is likely that many novel acylcarnitines will be discovered in the coming years. It is also likely that many novel roles in health and disease will be uncovered. An excellent review of the current state of knowledge for acylcarnitines is available at [Dambrova et al. 2021, Physiological Reviews].

   

(4,6)-Decadienoylcarnitine

3-(deca-4,6-dienoyloxy)-4-(trimethylazaniumyl)butanoate

C17H29NO4 (311.2096)


(4,6)-Decadienoylcarnitine is an acylcarnitine. More specifically, it is an deca-4,6-dienoic acid ester of carnitine. Acylcarnitines were first discovered more than 70 year ago (PMID: 13825279). It is believed that there are more than 1000 types of acylcarnitines in the human body. The general role of acylcarnitines is to transport acyl-groups (organic acids and fatty acids) from the cytoplasm into the mitochondria so that they can be broken down to produce energy. This process is known as beta-oxidation. According to a recent review [Dambrova et al. 2021, Physiological Reviews], acylcarnitines (ACs) can be classified into 9 different categories depending on the type and size of their acyl-group: 1) short-chain ACs; 2) medium-chain ACs; 3) long-chain ACs; 4) very long-chain ACs; 5) hydroxy ACs; 6) branched chain ACs; 7) unsaturated ACs; 8) dicarboxylic ACs and 9) miscellaneous ACs. Short-chain ACs have acyl-groups with two to five carbons (C2-C5), medium-chain ACs have acyl-groups with six to thirteen carbons (C6-C13), long-chain ACs have acyl-groups with fourteen to twenty once carbons (C14-C21) and very long-chain ACs have acyl groups with more than 22 carbons. (4,6)-Decadienoylcarnitine is therefore classified as a medium chain AC. As a medium-chain acylcarnitine (4,6)-Decadienoylcarnitine is somewhat less abundant than short-chain acylcarnitines. These are formed either through esterification with L-carnitine or through the peroxisomal metabolism of longer chain acylcarnitines (PMID: 30540494). Many medium-chain acylcarnitines can serve as useful markers for inherited disorders of fatty acid metabolism. In particular (4,6)-Decadienoylcarnitine is elevated in the blood or plasma of individuals with 2,4-dienoyl-coenzyme a reductase deficiency (PMID: 2332510, PMID: 15344554, PMID: 19578400). It is also decreased in the blood or plasma of individuals with familial mediterranean fever (PMID: 29900937) and schizophrenia (PMID: 31161852). Carnitine octanoyltransferase (CrOT, EC:2.3.1.137) is responsible for the synthesis of all medium-chain (MCAC, C5-C12) and medium-length branched-chain acylcarnitines in peroxisomes (PMID: 10486279). The study of acylcarnitines is an active area of research and it is likely that many novel acylcarnitines will be discovered in the coming years. It is also likely that many novel roles in health and disease will be uncovered. An excellent review of the current state of knowledge for acylcarnitines is available at [Dambrova et al. 2021, Physiological Reviews].

   

(5,8)-Decadienoylcarnitine

3-(deca-5,8-dienoyloxy)-4-(trimethylazaniumyl)butanoate

C17H29NO4 (311.2096)


(5,8)-Decadienoylcarnitine is an acylcarnitine. More specifically, it is an deca-5,8-dienoic acid ester of carnitine. Acylcarnitines were first discovered more than 70 year ago (PMID: 13825279). It is believed that there are more than 1000 types of acylcarnitines in the human body. The general role of acylcarnitines is to transport acyl-groups (organic acids and fatty acids) from the cytoplasm into the mitochondria so that they can be broken down to produce energy. This process is known as beta-oxidation. According to a recent review [Dambrova et al. 2021, Physiological Reviews], acylcarnitines (ACs) can be classified into 9 different categories depending on the type and size of their acyl-group: 1) short-chain ACs; 2) medium-chain ACs; 3) long-chain ACs; 4) very long-chain ACs; 5) hydroxy ACs; 6) branched chain ACs; 7) unsaturated ACs; 8) dicarboxylic ACs and 9) miscellaneous ACs. Short-chain ACs have acyl-groups with two to five carbons (C2-C5), medium-chain ACs have acyl-groups with six to thirteen carbons (C6-C13), long-chain ACs have acyl-groups with fourteen to twenty once carbons (C14-C21) and very long-chain ACs have acyl groups with more than 22 carbons. (5,8)-Decadienoylcarnitine is therefore classified as a medium chain AC. As a medium-chain acylcarnitine (5,8)-Decadienoylcarnitine is somewhat less abundant than short-chain acylcarnitines. These are formed either through esterification with L-carnitine or through the peroxisomal metabolism of longer chain acylcarnitines (PMID: 30540494). Many medium-chain acylcarnitines can serve as useful markers for inherited disorders of fatty acid metabolism. In particular (5,8)-Decadienoylcarnitine is elevated in the blood or plasma of individuals with 2,4-dienoyl-coenzyme a reductase deficiency (PMID: 2332510, PMID: 15344554, PMID: 19578400). It is also decreased in the blood or plasma of individuals with familial mediterranean fever (PMID: 29900937) and schizophrenia (PMID: 31161852). Carnitine octanoyltransferase (CrOT, EC:2.3.1.137) is responsible for the synthesis of all medium-chain (MCAC, C5-C12) and medium-length branched-chain acylcarnitines in peroxisomes (PMID: 10486279). The study of acylcarnitines is an active area of research and it is likely that many novel acylcarnitines will be discovered in the coming years. It is also likely that many novel roles in health and disease will be uncovered. An excellent review of the current state of knowledge for acylcarnitines is available at [Dambrova et al. 2021, Physiological Reviews].

   

(2,7)-Decadienoylcarnitine

3-(deca-2,7-dienoyloxy)-4-(trimethylazaniumyl)butanoate

C17H29NO4 (311.2096)


(2,7)-Decadienoylcarnitine is an acylcarnitine. More specifically, it is an deca-2,7-dienoic acid ester of carnitine. Acylcarnitines were first discovered more than 70 year ago (PMID: 13825279). It is believed that there are more than 1000 types of acylcarnitines in the human body. The general role of acylcarnitines is to transport acyl-groups (organic acids and fatty acids) from the cytoplasm into the mitochondria so that they can be broken down to produce energy. This process is known as beta-oxidation. According to a recent review [Dambrova et al. 2021, Physiological Reviews], acylcarnitines (ACs) can be classified into 9 different categories depending on the type and size of their acyl-group: 1) short-chain ACs; 2) medium-chain ACs; 3) long-chain ACs; 4) very long-chain ACs; 5) hydroxy ACs; 6) branched chain ACs; 7) unsaturated ACs; 8) dicarboxylic ACs and 9) miscellaneous ACs. Short-chain ACs have acyl-groups with two to five carbons (C2-C5), medium-chain ACs have acyl-groups with six to thirteen carbons (C6-C13), long-chain ACs have acyl-groups with fourteen to twenty once carbons (C14-C21) and very long-chain ACs have acyl groups with more than 22 carbons. (2,7)-Decadienoylcarnitine is therefore classified as a medium chain AC. As a medium-chain acylcarnitine (2,7)-Decadienoylcarnitine is somewhat less abundant than short-chain acylcarnitines. These are formed either through esterification with L-carnitine or through the peroxisomal metabolism of longer chain acylcarnitines (PMID: 30540494). Many medium-chain acylcarnitines can serve as useful markers for inherited disorders of fatty acid metabolism. In particular (2,7)-Decadienoylcarnitine is elevated in the blood or plasma of individuals with 2,4-dienoyl-coenzyme a reductase deficiency (PMID: 2332510, PMID: 15344554, PMID: 19578400). It is also decreased in the blood or plasma of individuals with familial mediterranean fever (PMID: 29900937) and schizophrenia (PMID: 31161852). Carnitine octanoyltransferase (CrOT, EC:2.3.1.137) is responsible for the synthesis of all medium-chain (MCAC, C5-C12) and medium-length branched-chain acylcarnitines in peroxisomes (PMID: 10486279). The study of acylcarnitines is an active area of research and it is likely that many novel acylcarnitines will be discovered in the coming years. It is also likely that many novel roles in health and disease will be uncovered. An excellent review of the current state of knowledge for acylcarnitines is available at [Dambrova et al. 2021, Physiological Reviews].

   

(4,7)-Decadienoylcarnitine

3-(deca-4,7-dienoyloxy)-4-(trimethylazaniumyl)butanoate

C17H29NO4 (311.2096)


(4,7)-Decadienoylcarnitine is an acylcarnitine. More specifically, it is an deca-4,7-dienoic acid ester of carnitine. Acylcarnitines were first discovered more than 70 year ago (PMID: 13825279). It is believed that there are more than 1000 types of acylcarnitines in the human body. The general role of acylcarnitines is to transport acyl-groups (organic acids and fatty acids) from the cytoplasm into the mitochondria so that they can be broken down to produce energy. This process is known as beta-oxidation. According to a recent review [Dambrova et al. 2021, Physiological Reviews], acylcarnitines (ACs) can be classified into 9 different categories depending on the type and size of their acyl-group: 1) short-chain ACs; 2) medium-chain ACs; 3) long-chain ACs; 4) very long-chain ACs; 5) hydroxy ACs; 6) branched chain ACs; 7) unsaturated ACs; 8) dicarboxylic ACs and 9) miscellaneous ACs. Short-chain ACs have acyl-groups with two to five carbons (C2-C5), medium-chain ACs have acyl-groups with six to thirteen carbons (C6-C13), long-chain ACs have acyl-groups with fourteen to twenty once carbons (C14-C21) and very long-chain ACs have acyl groups with more than 22 carbons. (4,7)-Decadienoylcarnitine is therefore classified as a medium chain AC. As a medium-chain acylcarnitine (4,7)-Decadienoylcarnitine is somewhat less abundant than short-chain acylcarnitines. These are formed either through esterification with L-carnitine or through the peroxisomal metabolism of longer chain acylcarnitines (PMID: 30540494). Many medium-chain acylcarnitines can serve as useful markers for inherited disorders of fatty acid metabolism. In particular (4,7)-Decadienoylcarnitine is elevated in the blood or plasma of individuals with 2,4-dienoyl-coenzyme a reductase deficiency (PMID: 2332510, PMID: 15344554, PMID: 19578400). It is also decreased in the blood or plasma of individuals with familial mediterranean fever (PMID: 29900937) and schizophrenia (PMID: 31161852). Carnitine octanoyltransferase (CrOT, EC:2.3.1.137) is responsible for the synthesis of all medium-chain (MCAC, C5-C12) and medium-length branched-chain acylcarnitines in peroxisomes (PMID: 10486279). The study of acylcarnitines is an active area of research and it is likely that many novel acylcarnitines will be discovered in the coming years. It is also likely that many novel roles in health and disease will be uncovered. An excellent review of the current state of knowledge for acylcarnitines is available at [Dambrova et al. 2021, Physiological Reviews].

   

(5,7)-Decadienoylcarnitine

3-(deca-5,7-dienoyloxy)-4-(trimethylazaniumyl)butanoate

C17H29NO4 (311.2096)


(5,7)-Decadienoylcarnitine is an acylcarnitine. More specifically, it is an deca-5,7-dienoic acid ester of carnitine. Acylcarnitines were first discovered more than 70 year ago (PMID: 13825279). It is believed that there are more than 1000 types of acylcarnitines in the human body. The general role of acylcarnitines is to transport acyl-groups (organic acids and fatty acids) from the cytoplasm into the mitochondria so that they can be broken down to produce energy. This process is known as beta-oxidation. According to a recent review [Dambrova et al. 2021, Physiological Reviews], acylcarnitines (ACs) can be classified into 9 different categories depending on the type and size of their acyl-group: 1) short-chain ACs; 2) medium-chain ACs; 3) long-chain ACs; 4) very long-chain ACs; 5) hydroxy ACs; 6) branched chain ACs; 7) unsaturated ACs; 8) dicarboxylic ACs and 9) miscellaneous ACs. Short-chain ACs have acyl-groups with two to five carbons (C2-C5), medium-chain ACs have acyl-groups with six to thirteen carbons (C6-C13), long-chain ACs have acyl-groups with fourteen to twenty once carbons (C14-C21) and very long-chain ACs have acyl groups with more than 22 carbons. (5,7)-Decadienoylcarnitine is therefore classified as a medium chain AC. As a medium-chain acylcarnitine (5,7)-Decadienoylcarnitine is somewhat less abundant than short-chain acylcarnitines. These are formed either through esterification with L-carnitine or through the peroxisomal metabolism of longer chain acylcarnitines (PMID: 30540494). Many medium-chain acylcarnitines can serve as useful markers for inherited disorders of fatty acid metabolism. In particular (5,7)-Decadienoylcarnitine is elevated in the blood or plasma of individuals with 2,4-dienoyl-coenzyme a reductase deficiency (PMID: 2332510, PMID: 15344554, PMID: 19578400). It is also decreased in the blood or plasma of individuals with familial mediterranean fever (PMID: 29900937) and schizophrenia (PMID: 31161852). Carnitine octanoyltransferase (CrOT, EC:2.3.1.137) is responsible for the synthesis of all medium-chain (MCAC, C5-C12) and medium-length branched-chain acylcarnitines in peroxisomes (PMID: 10486279). The study of acylcarnitines is an active area of research and it is likely that many novel acylcarnitines will be discovered in the coming years. It is also likely that many novel roles in health and disease will be uncovered. An excellent review of the current state of knowledge for acylcarnitines is available at [Dambrova et al. 2021, Physiological Reviews].

   

(4,8)-Decadienoylcarnitine

3-(deca-4,8-dienoyloxy)-4-(trimethylazaniumyl)butanoate

C17H29NO4 (311.2096)


(4,8)-Decadienoylcarnitine is an acylcarnitine. More specifically, it is an deca-4,8-dienoic acid ester of carnitine. Acylcarnitines were first discovered more than 70 year ago (PMID: 13825279). It is believed that there are more than 1000 types of acylcarnitines in the human body. The general role of acylcarnitines is to transport acyl-groups (organic acids and fatty acids) from the cytoplasm into the mitochondria so that they can be broken down to produce energy. This process is known as beta-oxidation. According to a recent review [Dambrova et al. 2021, Physiological Reviews], acylcarnitines (ACs) can be classified into 9 different categories depending on the type and size of their acyl-group: 1) short-chain ACs; 2) medium-chain ACs; 3) long-chain ACs; 4) very long-chain ACs; 5) hydroxy ACs; 6) branched chain ACs; 7) unsaturated ACs; 8) dicarboxylic ACs and 9) miscellaneous ACs. Short-chain ACs have acyl-groups with two to five carbons (C2-C5), medium-chain ACs have acyl-groups with six to thirteen carbons (C6-C13), long-chain ACs have acyl-groups with fourteen to twenty once carbons (C14-C21) and very long-chain ACs have acyl groups with more than 22 carbons. (4,8)-Decadienoylcarnitine is therefore classified as a medium chain AC. As a medium-chain acylcarnitine (4,8)-Decadienoylcarnitine is somewhat less abundant than short-chain acylcarnitines. These are formed either through esterification with L-carnitine or through the peroxisomal metabolism of longer chain acylcarnitines (PMID: 30540494). Many medium-chain acylcarnitines can serve as useful markers for inherited disorders of fatty acid metabolism. In particular (4,8)-Decadienoylcarnitine is elevated in the blood or plasma of individuals with 2,4-dienoyl-coenzyme a reductase deficiency (PMID: 2332510, PMID: 15344554, PMID: 19578400). It is also decreased in the blood or plasma of individuals with familial mediterranean fever (PMID: 29900937) and schizophrenia (PMID: 31161852). Carnitine octanoyltransferase (CrOT, EC:2.3.1.137) is responsible for the synthesis of all medium-chain (MCAC, C5-C12) and medium-length branched-chain acylcarnitines in peroxisomes (PMID: 10486279). The study of acylcarnitines is an active area of research and it is likely that many novel acylcarnitines will be discovered in the coming years. It is also likely that many novel roles in health and disease will be uncovered. An excellent review of the current state of knowledge for acylcarnitines is available at [Dambrova et al. 2021, Physiological Reviews].

   

(3,7)-Decadienoylcarnitine

3-(deca-3,7-dienoyloxy)-4-(trimethylazaniumyl)butanoate

C17H29NO4 (311.2096)


(3,7)-Decadienoylcarnitine is an acylcarnitine. More specifically, it is an deca-3,7-dienoic acid ester of carnitine. Acylcarnitines were first discovered more than 70 year ago (PMID: 13825279). It is believed that there are more than 1000 types of acylcarnitines in the human body. The general role of acylcarnitines is to transport acyl-groups (organic acids and fatty acids) from the cytoplasm into the mitochondria so that they can be broken down to produce energy. This process is known as beta-oxidation. According to a recent review [Dambrova et al. 2021, Physiological Reviews], acylcarnitines (ACs) can be classified into 9 different categories depending on the type and size of their acyl-group: 1) short-chain ACs; 2) medium-chain ACs; 3) long-chain ACs; 4) very long-chain ACs; 5) hydroxy ACs; 6) branched chain ACs; 7) unsaturated ACs; 8) dicarboxylic ACs and 9) miscellaneous ACs. Short-chain ACs have acyl-groups with two to five carbons (C2-C5), medium-chain ACs have acyl-groups with six to thirteen carbons (C6-C13), long-chain ACs have acyl-groups with fourteen to twenty once carbons (C14-C21) and very long-chain ACs have acyl groups with more than 22 carbons. (3,7)-Decadienoylcarnitine is therefore classified as a medium chain AC. As a medium-chain acylcarnitine (3,7)-Decadienoylcarnitine is somewhat less abundant than short-chain acylcarnitines. These are formed either through esterification with L-carnitine or through the peroxisomal metabolism of longer chain acylcarnitines (PMID: 30540494). Many medium-chain acylcarnitines can serve as useful markers for inherited disorders of fatty acid metabolism. In particular (3,7)-Decadienoylcarnitine is elevated in the blood or plasma of individuals with 2,4-dienoyl-coenzyme a reductase deficiency (PMID: 2332510, PMID: 15344554, PMID: 19578400). It is also decreased in the blood or plasma of individuals with familial mediterranean fever (PMID: 29900937) and schizophrenia (PMID: 31161852). Carnitine octanoyltransferase (CrOT, EC:2.3.1.137) is responsible for the synthesis of all medium-chain (MCAC, C5-C12) and medium-length branched-chain acylcarnitines in peroxisomes (PMID: 10486279). The study of acylcarnitines is an active area of research and it is likely that many novel acylcarnitines will be discovered in the coming years. It is also likely that many novel roles in health and disease will be uncovered. An excellent review of the current state of knowledge for acylcarnitines is available at [Dambrova et al. 2021, Physiological Reviews].

   

(2,5)-Decadienoylcarnitine

3-(deca-2,5-dienoyloxy)-4-(trimethylazaniumyl)butanoate

C17H29NO4 (311.2096)


(2,5)-Decadienoylcarnitine is an acylcarnitine. More specifically, it is an deca-2,5-dienoic acid ester of carnitine. Acylcarnitines were first discovered more than 70 year ago (PMID: 13825279). It is believed that there are more than 1000 types of acylcarnitines in the human body. The general role of acylcarnitines is to transport acyl-groups (organic acids and fatty acids) from the cytoplasm into the mitochondria so that they can be broken down to produce energy. This process is known as beta-oxidation. According to a recent review [Dambrova et al. 2021, Physiological Reviews], acylcarnitines (ACs) can be classified into 9 different categories depending on the type and size of their acyl-group: 1) short-chain ACs; 2) medium-chain ACs; 3) long-chain ACs; 4) very long-chain ACs; 5) hydroxy ACs; 6) branched chain ACs; 7) unsaturated ACs; 8) dicarboxylic ACs and 9) miscellaneous ACs. Short-chain ACs have acyl-groups with two to five carbons (C2-C5), medium-chain ACs have acyl-groups with six to thirteen carbons (C6-C13), long-chain ACs have acyl-groups with fourteen to twenty once carbons (C14-C21) and very long-chain ACs have acyl groups with more than 22 carbons. (2,5)-Decadienoylcarnitine is therefore classified as a medium chain AC. As a medium-chain acylcarnitine (2,5)-Decadienoylcarnitine is somewhat less abundant than short-chain acylcarnitines. These are formed either through esterification with L-carnitine or through the peroxisomal metabolism of longer chain acylcarnitines (PMID: 30540494). Many medium-chain acylcarnitines can serve as useful markers for inherited disorders of fatty acid metabolism. In particular (2,5)-Decadienoylcarnitine is elevated in the blood or plasma of individuals with 2,4-dienoyl-coenzyme a reductase deficiency (PMID: 2332510, PMID: 15344554, PMID: 19578400). It is also decreased in the blood or plasma of individuals with familial mediterranean fever (PMID: 29900937) and schizophrenia (PMID: 31161852). Carnitine octanoyltransferase (CrOT, EC:2.3.1.137) is responsible for the synthesis of all medium-chain (MCAC, C5-C12) and medium-length branched-chain acylcarnitines in peroxisomes (PMID: 10486279). The study of acylcarnitines is an active area of research and it is likely that many novel acylcarnitines will be discovered in the coming years. It is also likely that many novel roles in health and disease will be uncovered. An excellent review of the current state of knowledge for acylcarnitines is available at [Dambrova et al. 2021, Physiological Reviews].

   

(1-Pentyl-1H-indol-3-yl)(2,2,3,3-tetramethylcyclopropyl)methanone

(1-Pentyl-1H-indol-3-yl)(2,2,3,3-tetramethylcyclopropyl)methanone

C21H29NO (311.2249)


   

1-(1-Pentyl-1h-indol-3-yl)-3-methyl-2-(propan-2-yl)but-3-en-1-one

1-(1-Pentyl-1h-indol-3-yl)-3-methyl-2-(propan-2-yl)but-3-en-1-one

C21H29NO (311.2249)


   

3-(((4,7-Dimethyl-1,3-benzoxazol-2-yl)methyl)amino)-5-ethyl-6-methylpyridin-2(1H)-one

3-{[(4,7-dimethyl-1,3-benzoxazol-2-yl)methyl]amino}-5-ethyl-6-methyl-1,2-dihydropyridin-2-one

C18H21N3O2 (311.1634)


   

Ac-Pro-Gly-Pro-OH

1-[2-[(1-Acetylpyrrolidine-2-carbonyl)amino]acetyl]pyrrolidine-2-carboxylic acid

C14H21N3O5 (311.1481)


   

Vephylline

7-{2-[bis(2-hydroxyethyl)amino]ethyl}-1,3-dimethyl-2,3,6,7-tetrahydro-1H-purine-2,6-dione

C13H21N5O4 (311.1593)


   

Butofilolol

1-{2-[3-(tert-butylamino)-2-hydroxypropoxy]-5-fluorophenyl}butan-1-one

C17H26FNO3 (311.1897)


   

Chloramitriptyline

(3-{14-chlorotricyclo[9.4.0.0^{3,8}]pentadeca-1(11),3,5,7,12,14-hexaen-2-ylidene}propyl)dimethylamine

C20H22ClN (311.1441)


   

10H-Pyrido(3,2-b)(1,4)benzothiazine, 10-(2-piperidinoethyl)-

2-[2-(piperidin-1-yl)ethyl]-9-thia-2,4-diazatricyclo[8.4.0.0^{3,8}]tetradeca-1(14),3(8),4,6,10,12-hexaene

C18H21N3S (311.1456)


   

10-((1-Methyl-3-piperidyl)methyl)-10H-pyrido(3,2-b)(1,4)benzothiazine

2-[(1-methylpiperidin-3-yl)methyl]-9-thia-2,4-diazatricyclo[8.4.0.0^{3,8}]tetradeca-1(14),3(8),4,6,10,12-hexaene

C18H21N3S (311.1456)


   

Dienogest

2-{14-hydroxy-15-methyl-5-oxotetracyclo[8.7.0.0^{2,7}.0^{11,15}]heptadeca-1,6-dien-14-yl}acetonitrile

C20H25NO2 (311.1885)


   

Dimepheptanol

(3R,6R)-3-Acetoxy-6-dimethylamino-4,4-diphenylheptane

C21H29NO (311.2249)


   

Femoxetine

trans-3-((4-Methoxyphenoxy)methyl)-1-methyl-4-phenylpiperidine

C20H25NO2 (311.1885)


   

Val-pro-pro

1-[1-(2-amino-3-methylbutanoyl)pyrrolidine-2-carbonyl]pyrrolidine-2-carboxylic acid

C15H25N3O4 (311.1845)


   

Lethidrone

4-(prop-2-en-1-yl)-12-oxa-4-azapentacyclo[9.6.1.0^{1,13}.0^{5,17}.0^{7,18}]octadeca-7(18),8,10,15-tetraene-10,14-diol

C19H21NO3 (311.1521)


D002492 - Central Nervous System Depressants > D009294 - Narcotics > D053610 - Opiate Alkaloids D018373 - Peripheral Nervous System Agents > D018689 - Sensory System Agents D002491 - Central Nervous System Agents > D009292 - Narcotic Antagonists

   

Noberastine

N-{3-[(5-methylfuran-2-yl)methyl]-3H-imidazo[4,5-b]pyridin-2-yl}piperidin-4-amine

C17H21N5O (311.1746)


C308 - Immunotherapeutic Agent > C29578 - Histamine-1 Receptor Antagonist

   

Norpropoxyphene amide

N-(3-Hydroxy-2-methyl-3,4-diphenylbutyl)propanimidate

C20H25NO2 (311.1885)


   

Dinorpropoxyphene

4-Amino-3-methyl-1,2-diphenylbutan-2-yl propanoic acid

C20H25NO2 (311.1885)


   

Xanthinol

7-{2-hydroxy-3-[(2-hydroxyethyl)(methyl)amino]propyl}-1,3-dimethyl-2,3,6,7-tetrahydro-1H-purine-2,6-dione

C13H21N5O4 (311.1593)


   

(9S,10E,12Z)-9-hydroperoxy-10,12-octadecadienoate

(10E,12Z)-(9S)-9-Hydroperoxyoctadeca-10,12-dienoic acid

C18H31O4 (311.2222)


(9s,10e,12z)-9-hydroperoxy-10,12-octadecadienoate, also known as 9(S)-hydroperoxy-10(E),12(z)-octadecadienoic acid or 9(S)-hpod(1-), belongs to lineolic acids and derivatives class of compounds. Those are derivatives of lineolic acid. Lineolic acid is a polyunsaturated omega-6 18 carbon long fatty acid, with two CC double bonds at the 9- and 12-positions (9s,10e,12z)-9-hydroperoxy-10,12-octadecadienoate is practically insoluble (in water) and a weakly acidic compound (based on its pKa). (9s,10e,12z)-9-hydroperoxy-10,12-octadecadienoate can be found in a number of food items such as mexican groundcherry, brazil nut, coconut, and winter savory, which makes (9s,10e,12z)-9-hydroperoxy-10,12-octadecadienoate a potential biomarker for the consumption of these food products.

   
   
   

Isolysergic acid alpha-hydroxy ethylamide

Isolysergic acid alpha-hydroxy ethylamide

C18H21N3O2 (311.1634)


   
   

O-Methylisopiline

O-Methylisopiline

C19H21NO3 (311.1521)


   

N-Methylisopiline

N-Methylisopiline

C19H21NO3 (311.1521)


   
   
   

Axinisothiocyanate I

Axinisothiocyanate I

C16H25NO3S (311.1555)


   

6-Methoxydictyolomide A

(+)-6-Methoxydictyolomide A

C20H25NO2 (311.1885)


   

CJ 13568

(E)-(-)-2-(3-Hydroxy-3,7-dimethyl-1,6-octadienyl)-1-methyl-4(1H)-quinolinone

C20H25NO2 (311.1885)


   

(Z)-1-Methyl-2-(undec-5-enyl)quinolin-4-one

(Z)-1-Methyl-2-(undec-5-enyl)quinolin-4-one

C21H29NO (311.2249)


   

(-)-Nuciferoline

(-)-Nuciferoline

C19H21NO3 (311.1521)


   

Malouetafrine

Malouetafrine

C21H29NO (311.2249)


   
   

CJ 13567

(E)-(+)-2-(1-hydroxy-3,7-dimethyl-2,6-octadienyl)-1-methyl-4(1H)-1uinolinone

C20H25NO2 (311.1885)


   

Pseudomanibacanine

Pseudomanibacanine

C19H21NO3 (311.1521)


   
   
   

1-Methyl-2-[(Z)-6-undecenyl]quinolin-4-one

1-Methyl-2-[(Z)-6-undecenyl]quinolin-4-one

C21H29NO (311.2249)


   
   
   

3-Hydroxynuciferine

3-Hydroxynuciferine

C19H21NO3 (311.1521)


   
   

11-Dehydrokobusine

11-Dehydrokobusine

C20H25NO2 (311.1885)


   
   
   

Lysergic acid alpha-hydroxyethylamide

Lysergic acid alpha-hydroxyethylamide

C18H21N3O2 (311.1634)


   

Dienogest

Dienogest

C20H25NO2 (311.1885)


G - Genito urinary system and sex hormones > G03 - Sex hormones and modulators of the genital system > G03D - Progestogens > G03DB - Pregnadien derivatives C147908 - Hormone Therapy Agent > C548 - Therapeutic Hormone > C1636 - Therapeutic Steroid Hormone D006730 - Hormones, Hormone Substitutes, and Hormone Antagonists > D006727 - Hormone Antagonists D006730 - Hormones, Hormone Substitutes, and Hormone Antagonists > D006728 - Hormones D012102 - Reproductive Control Agents > D003270 - Contraceptive Agents D000970 - Antineoplastic Agents CONFIDENCE standard compound; EAWAG_UCHEM_ID 3284

   
   

(1Z)-4-Isopropyl-1-(2-methylpropylidene)-2H-pyrazino[2,1-b]quinazoline-3,6(1H,4H)-dione

(1Z)-4-Isopropyl-1-(2-methylpropylidene)-2H-pyrazino[2,1-b]quinazoline-3,6(1H,4H)-dione

C18H21N3O2 (311.1634)


   

1-Benzyl-N-(2-nitrophenyl)piperidin-4-amine

1-Benzyl-N-(2-nitrophenyl)piperidin-4-amine

C18H21N3O2 (311.1634)


   

UNII-L26S4AX8CG

UNII-L26S4AX8CG

C21H29NO (311.2249)


   
   

adiphenine

2-(diethylamino)ethyl 2,2-diphenylacetate

C20H25NO2 (311.1885)


C78272 - Agent Affecting Nervous System > C29698 - Antispasmodic Agent

   

Hordenine-O-??-L-rhamnopyranoside

Hordenine-O-??-L-rhamnopyranoside

C16H25NO5 (311.1733)


   

SCHEMBL13812248

SCHEMBL13812248

C15H17N7O (311.1495)


   

(-)-beta-8-methylpseudoanibacanine|(8S,13aS)-form-8-Methylpseudoanibacanine

(-)-beta-8-methylpseudoanibacanine|(8S,13aS)-form-8-Methylpseudoanibacanine

C19H21NO3 (311.1521)


   

Kalihipyran

Kalihipyran

C21H29NO (311.2249)


   

1,10-dimethoxy-6-methyl-aporphan-11-ol|isothebaine

1,10-dimethoxy-6-methyl-aporphan-11-ol|isothebaine

C19H21NO3 (311.1521)


   

Lysergylmethyl-carbinolamide

Lysergylmethyl-carbinolamide

C18H21N3O2 (311.1634)


   
   
   

(-)-2-Hydroxy-3,8-dimethoxypavinane

(-)-2-Hydroxy-3,8-dimethoxypavinane

C19H21NO3 (311.1521)


   

CBMicro_015029

CBMicro_015029

C19H21NO3 (311.1521)


   
   
   

15,16-methanediyldioxy-3alpha-methoxy-11a-homo-erythrina-1,6-diene|Schelhammeridin|Schelhammeridine

15,16-methanediyldioxy-3alpha-methoxy-11a-homo-erythrina-1,6-diene|Schelhammeridin|Schelhammeridine

C19H21NO3 (311.1521)


   

2-Methylbutyric acid 2-[(2-hydroxyethyl)amino]-1,5-dimethyl-4-methoxy-6-oxo-2,4-cyclohexadien-1-yl ester

2-Methylbutyric acid 2-[(2-hydroxyethyl)amino]-1,5-dimethyl-4-methoxy-6-oxo-2,4-cyclohexadien-1-yl ester

C16H25NO5 (311.1733)


   

1-methyl-2-(3-hydroxy-3,7-dimethyl-octa-1,6-dienyl)quinolin-4(1h)-one

1-methyl-2-(3-hydroxy-3,7-dimethyl-octa-1,6-dienyl)quinolin-4(1h)-one

C20H25NO2 (311.1885)


   

Cyclo-(leucyl=>valyl=>valyl)

Cyclo-(leucyl=>valyl=>valyl)

C16H29N3O3 (311.2209)


   

2-[2-(3,4-dimethoxyphenyl)ethyl]-1-methyl-3,4-dihydro-2H-quinoline

2-[2-(3,4-dimethoxyphenyl)ethyl]-1-methyl-3,4-dihydro-2H-quinoline

C20H25NO2 (311.1885)


   

seco-pseudopteroxazole

seco-pseudopteroxazole

C21H29NO (311.2249)


A natural product found in Pseudopterogorgia elisabethae.

   

Secoquettamine

Secoquettamine

C19H21NO3 (311.1521)


   
   

(S)-3-((2-(2-methylbut-3-en-2-yl)-1H-indol-3-yl)methyl)piperazine-2,5-dione|talathermophilin E

(S)-3-((2-(2-methylbut-3-en-2-yl)-1H-indol-3-yl)methyl)piperazine-2,5-dione|talathermophilin E

C18H21N3O2 (311.1634)


   

mafaicheenamine B

mafaicheenamine B

C19H21NO3 (311.1521)


   

1-methyl-2-[(E)-1-undecenyl]-4(1H)-quinolone|1-methyl-2-[(E)-1-undecenyl]-4(1H)-quinolone

1-methyl-2-[(E)-1-undecenyl]-4(1H)-quinolone|1-methyl-2-[(E)-1-undecenyl]-4(1H)-quinolone

C21H29NO (311.2249)


   

DTXSID30482052

DTXSID30482052

C20H25NO2 (311.1885)


   
   

(S)-Doryafranine

(S)-Doryafranine

C19H21NO3 (311.1521)


   

cucurbinoyl-isoleucine

cucurbinoyl-isoleucine

C17H29NO4 (311.2096)


   

CHEMBL3303761

CHEMBL3303761

C20H25NO2 (311.1885)


   

norholadiene

norholadiene

C21H29NO (311.2249)


   
   

1,2-Dimethoxy-11-hydroxyaporphin

1,2-Dimethoxy-11-hydroxyaporphin

C19H21NO3 (311.1521)


   

Furoerioaustralasine

Furoerioaustralasine

C19H21NO3 (311.1521)


   
   

(?)-liridinine|Liridinine

(?)-liridinine|Liridinine

C19H21NO3 (311.1521)


   

(+/-)-1-hydroxy-2,9-dimethoxyaporphine|2,9-dimethoxy-6-methyl-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinolin-1-ol|dl-Lirinine|Lirinin|Orientinine

(+/-)-1-hydroxy-2,9-dimethoxyaporphine|2,9-dimethoxy-6-methyl-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinolin-1-ol|dl-Lirinine|Lirinin|Orientinine

C19H21NO3 (311.1521)


   
   

7-Prenyloxyflindersine

7-Prenyloxyflindersine

C19H21NO3 (311.1521)


   

15,16-ethane-1,2-diyldioxy-3beta-methoxy-erythrina-1,6-diene|Erythralin

15,16-ethane-1,2-diyldioxy-3beta-methoxy-erythrina-1,6-diene|Erythralin

C19H21NO3 (311.1521)


   

1-Methyl-2-(undec-6-en-1-yl)quinolin-4(1H)-one

1-Methyl-2-(undec-6-en-1-yl)quinolin-4(1H)-one

C21H29NO (311.2249)


   
   

(-)-alpha-8-methylanibacanine|(8R,13aS)-form-8-Methylanibacanine

(-)-alpha-8-methylanibacanine|(8R,13aS)-form-8-Methylanibacanine

C19H21NO3 (311.1521)


   

1,2,11-trimethoxynoraporphine

1,2,11-trimethoxynoraporphine

C19H21NO3 (311.1521)


   

MCULE-5344492193

MCULE-5344492193

C19H21NO3 (311.1521)


   
   
   
   
   
   
   
   
   

1-methyl-2-undec-6-enylquinolin-4-one

1-Methyl-2-(undec-6-en-1-yl)quinolin-4(1H)-one

C21H29NO (311.2249)


   

1-Methyl-2-[(Z)-5-undecenyl]-4(1H)-quinolone

4(1H)-Quinolinone, 1-methyl-2-(5Z)-5-undecen-1-yl-

C21H29NO (311.2249)


   

thebaine

thebaine

C19H21NO3 (311.1521)


D002491 - Central Nervous System Agents > D000697 - Central Nervous System Stimulants > D003292 - Convulsants D002491 - Central Nervous System Agents > D002492 - Central Nervous System Depressants > D009294 - Narcotics D002492 - Central Nervous System Depressants > D009294 - Narcotics > D053610 - Opiate Alkaloids C78272 - Agent Affecting Nervous System > C67413 - Opioid Receptor Agonist > C1657 - Opiate D018373 - Peripheral Nervous System Agents > D018689 - Sensory System Agents D002491 - Central Nervous System Agents > D000700 - Analgesics relative retention time with respect to 9-anthracene Carboxylic Acid is 0.549 relative retention time with respect to 9-anthracene Carboxylic Acid is 0.537 IPB_RECORD: 2881; CONFIDENCE confident structure

   

THEBAINE

NCGC00160239-01!THEBAINE

C19H21NO3 (311.1521)


   

C21H29NO_1-Methyl-2-[(6Z)-6-undecen-1-yl]-4(1H)-quinolinone

NCGC00385992-01_C21H29NO_1-Methyl-2-[(6Z)-6-undecen-1-yl]-4(1H)-quinolinone

C21H29NO (311.2249)


   

C18H21N3O2_(1Z)-4-Isopropyl-1-(2-methylpropylidene)-2H-pyrazino[2,1-b]quinazoline-3,6(1H,4H)-dione

NCGC00385185-01_C18H21N3O2_(1Z)-4-Isopropyl-1-(2-methylpropylidene)-2H-pyrazino[2,1-b]quinazoline-3,6(1H,4H)-dione

C18H21N3O2 (311.1634)


   

1-(2-methylpropylidene)-4-(propan-2-yl)-1H,2H,3H,4H,6H-piperazino[2,1-b]quinazoline-3,6-dione

1-(2-methylpropylidene)-4-(propan-2-yl)-1H,2H,3H,4H,6H-piperazino[2,1-b]quinazoline-3,6-dione

C18H21N3O2 (311.1634)


   

(1-Pentyl-1H-indol-3-yl)(2,2,3,3-tetramethylcyclopropyl)methanone

(1-Pentyl-1H-indol-3-yl)(2,2,3,3-tetramethylcyclopropyl)methanone

C21H29NO (311.2249)


   
   

biperiden

biperiden

C21H29NO (311.2249)


D002491 - Central Nervous System Agents > D018726 - Anti-Dyskinesia Agents > D000978 - Antiparkinson Agents N - Nervous system > N04 - Anti-parkinson drugs > N04A - Anticholinergic agents > N04AA - Tertiary amines C78272 - Agent Affecting Nervous System > C66880 - Anticholinergic Agent > C29704 - Antimuscarinic Agent D018373 - Peripheral Nervous System Agents > D001337 - Autonomic Agents > D010276 - Parasympatholytics D018377 - Neurotransmitter Agents > D018678 - Cholinergic Agents > D018680 - Cholinergic Antagonists C78272 - Agent Affecting Nervous System > C38149 - Antiparkinsonian Agent Biperiden (KL 373) is a non-selective muscarinic receptor antagonist that competitively binds to M1 muscarinic receptors, thereby inhibiting acetylcholine and enhancing dopamine signaling in the central nervous system. Biperiden has the potential for the research of Parkinson's disease and other related psychiatric disorders[1][2].

   

Cinnamoyl homoveratrylamine

Cinnamoyl homoveratrylamine

C19H21NO3 (311.1521)


   

Pretilachlor

Pretilachlor

C17H26ClNO2 (311.1652)


Precursor ion is [M+H]+ of 37Cl-containing molecule.; The sample was injected by direct infusion.; This record was created by the financial support of MEXT/JSPS KAKENHI Grant Number 19HP8024 to the Mass Spectrometry Society of Japan. The sample was injected by direct infusion.; This record was created by the financial support of MEXT/JSPS KAKENHI Grant Number 19HP8024 to the Mass Spectrometry Society of Japan.

   

3-oxo-C13-HSL

3-oxo-C13-HSL

C17H29NO4 (311.2096)


   

N6-Methylisoeugenolyl-adenine

N6-Methylisoeugenolyl-adenine

C16H17N5O2 (311.1382)


   

17-hydroxy-3-oxo-, (17??)-19-Norpregna-5(10),9(11)-diene-21-nitrile

17-hydroxy-3-oxo-, (17??)-19-Norpregna-5(10),9(11)-diene-21-nitrile

C20H25NO2 (311.1885)


   
   
   

Dinorpropoxyphene

Dinorpropoxyphene

C20H25NO2 (311.1885)


   
   
   

Desmethylergometrine

Desmethylergometrine

C18H21N3O2 (311.1634)


   
   

Arg-his

2-[2-amino-3-(1H-imidazol-5-yl)propanamido]-5-carbamimidamidopentanoic acid

C12H21N7O3 (311.1706)


   

His-arg

2-(2-amino-5-carbamimidamidopentanamido)-3-(1H-imidazol-5-yl)propanoic acid

C12H21N7O3 (311.1706)


   

(-)-Thebaine

10,14-dimethoxy-4-methyl-12-oxa-4-azapentacyclo[9.6.1.0^{1,13}.0^{5,17}.0^{7,18}]octadeca-7(18),8,10,14,16-pentaene

C19H21NO3 (311.1521)


   

Lansimide 3

3-hydroxy-5-[methoxy(phenyl)methyl]-1-methyl-4-phenylpyrrolidin-2-one

C19H21NO3 (311.1521)


   

Piperettine

(2E,4E,6E)-7-(2H-1,3-benzodioxol-5-yl)-1-(piperidin-1-yl)hepta-2,4,6-trien-1-one

C19H21NO3 (311.1521)


   

Lansamide 4

3-Hydroxy-6-methoxy-1-methyl-4,5-diphenyl-2-piperidinone

C19H21NO3 (311.1521)


A 3-hydroxy-6-methoxy-1-methyl-4,5-diphenyl-2-piperidinone in which positions 3,4,5 and 6 have S,S,R,R stereochemistry, respectively.

   

Aegle marmelos alkaloid D

(2E)-N-[2-methoxy-2-(4-methoxyphenyl)ethyl]-3-phenylprop-2-enamide

C19H21NO3 (311.1521)


   

CAR 10:2

3-[(2E,4Z)-deca-2,4-dienoyloxy]-4-(trimethylammonio)butanoate;cis-4-trans-2-decadienoylcarnitine

C17H29NO4 (311.2096)


   

3-(Dimethylamino)-1,2-bis(4-methoxyphenyl)-2-propen-1-one

3-(Dimethylamino)-1,2-bis(4-methoxyphenyl)-2-propen-1-one

C19H21NO3 (311.1521)


   

4-[1-[(4-fluorophenyl)methyl]benzimidazol-2-yl]morpholine

4-[1-[(4-fluorophenyl)methyl]benzimidazol-2-yl]morpholine

C18H18FN3O (311.1434)


   

Alphamethadol

Alphamethadol

C21H29NO (311.2249)


D002491 - Central Nervous System Agents > D002492 - Central Nervous System Depressants > D009294 - Narcotics D018373 - Peripheral Nervous System Agents > D018689 - Sensory System Agents C78272 - Agent Affecting Nervous System > C67413 - Opioid Receptor Agonist D002491 - Central Nervous System Agents > D000700 - Analgesics C78272 - Agent Affecting Nervous System > C241 - Analgesic Agent

   

5-Pyrimidinecarbonitrile, 4-amino-2-(2,5-dihydroxyphenyl)-6-(3-piperidinyl)-

5-Pyrimidinecarbonitrile, 4-amino-2-(2,5-dihydroxyphenyl)-6-(3-piperidinyl)-

C16H17N5O2 (311.1382)


   

N,N-dimethyl-1-spiro[1,3-dioxolane-2,11-6H-benzo[c][1]benzoxepine]-4-ylmethanamine

N,N-dimethyl-1-spiro[1,3-dioxolane-2,11-6H-benzo[c][1]benzoxepine]-4-ylmethanamine

C19H21NO3 (311.1521)


   

Butofilolol

Butofilolol

C17H26FNO3 (311.1897)


C78272 - Agent Affecting Nervous System > C29747 - Adrenergic Agent > C72900 - Adrenergic Antagonist D018377 - Neurotransmitter Agents > D018663 - Adrenergic Agents > D018674 - Adrenergic Antagonists

   

tert-butyl 4-[(6-chloropyridin-3-yl)methyl]piperazine-1-carboxylate

tert-butyl 4-[(6-chloropyridin-3-yl)methyl]piperazine-1-carboxylate

C15H22ClN3O2 (311.14)


   
   

Bufenadrine

Bufenadrine

C21H29NO (311.2249)


   

2-Ethylhexyl 2-cyano-5-phenyl-2,4-pentadienoate

2-Ethylhexyl 2-cyano-5-phenyl-2,4-pentadienoate

C20H25NO2 (311.1885)


   

2-[(1-ADAMANTYLCARBONYL)AMINO]-4-(METHYLTHIO)BUTANOIC ACID

2-[(1-ADAMANTYLCARBONYL)AMINO]-4-(METHYLTHIO)BUTANOIC ACID

C16H25NO3S (311.1555)


   

tert-butyl 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)piperidine-1-carboxylate

tert-butyl 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)piperidine-1-carboxylate

C16H30BNO4 (311.2268)


   

2-(3-(tert-butoxycarbonyl)-3-azaspiro[5.5]undecane-9-yl)acetic acid

2-(3-(tert-butoxycarbonyl)-3-azaspiro[5.5]undecane-9-yl)acetic acid

C17H29NO4 (311.2096)


   

1-BENZYL-4-(4-NITROBENZYL)PIPERAZINE

1-BENZYL-4-(4-NITROBENZYL)PIPERAZINE

C18H21N3O2 (311.1634)


   

(1R, 2R)-Pseudoephedrine-(S)-2-methylhydrocinnamamide

(1R, 2R)-Pseudoephedrine-(S)-2-methylhydrocinnamamide

C20H25NO2 (311.1885)


   

(4-(5-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)PYRIDIN-3-YL)PHENYL)METHANOL

(4-(5-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)PYRIDIN-3-YL)PHENYL)METHANOL

C18H22BNO3 (311.1693)


   

(3S,6R)-6-(Dimethylamino)-4,4-diphenyl-3-heptanol

(3S,6R)-6-(Dimethylamino)-4,4-diphenyl-3-heptanol

C21H29NO (311.2249)


   

Piperazine, 2-Methyl-4-(4-nitrophenyl)-1-(phenylmethyl)-, (2R)-

Piperazine, 2-Methyl-4-(4-nitrophenyl)-1-(phenylmethyl)-, (2R)-

C18H21N3O2 (311.1634)


   

N-(3-methoxyphenyl)-2-[4-(2-methylpropyl)phenyl]propanamide

N-(3-methoxyphenyl)-2-[4-(2-methylpropyl)phenyl]propanamide

C20H25NO2 (311.1885)


   

buta-1,3-diene,methyl 2-methylprop-2-enoate,prop-2-enenitrile,styrene

buta-1,3-diene,methyl 2-methylprop-2-enoate,prop-2-enenitrile,styrene

C20H25NO2 (311.1885)


   

(S)-(-)N-CARBOMETHOXY-ALPHA,ALPHA-DIPHENYL-2-PYRROLIDINEMETHANOL,98

(S)-(-)N-CARBOMETHOXY-ALPHA,ALPHA-DIPHENYL-2-PYRROLIDINEMETHANOL,98

C19H21NO3 (311.1521)


   

(2R,4S)-ethyl 5-([1,1-biphenyl]-4-yl)-4-amino-2-Methylpentanoate

(2R,4S)-ethyl 5-([1,1-biphenyl]-4-yl)-4-amino-2-Methylpentanoate

C20H25NO2 (311.1885)


   

3,5-DICHLOROBENZENE-1-CARBOXIMIDAMIDEHYDROCHLORIDE

3,5-DICHLOROBENZENE-1-CARBOXIMIDAMIDEHYDROCHLORIDE

C18H21N3O2 (311.1634)


   

eserine hydrochloride

eserine hydrochloride

C15H22ClN3O2 (311.14)


   

Boc-Cys(pMeBzl)-ol

Boc-Cys(pMeBzl)-ol

C16H25NO3S (311.1555)


   

Talsupram

Talsupram

C20H25NS (311.1708)


C78272 - Agent Affecting Nervous System > C29747 - Adrenergic Agent > C185721 - Norepinephrine Reuptake Inhibitor C78272 - Agent Affecting Nervous System > C265 - Antidepressant Agent

   

3-[(3-methoxyphenyl)methyl]-7,7-dimethyl-6,8-dihydro-1H-quinoline-2,5-dione

3-[(3-methoxyphenyl)methyl]-7,7-dimethyl-6,8-dihydro-1H-quinoline-2,5-dione

C19H21NO3 (311.1521)


   

BASIONIC(TM) ST 62

BASIONIC(TM) ST 62

C14H33NO4S (311.213)


   

Cyclobenzaprine hydrochloride

Cyclobenzaprine hydrochloride

C20H22ClN (311.1441)


D002491 - Central Nervous System Agents > D011619 - Psychotropic Drugs > D000928 - Antidepressive Agents D002491 - Central Nervous System Agents > D011619 - Psychotropic Drugs > D014149 - Tranquilizing Agents D002491 - Central Nervous System Agents > D002492 - Central Nervous System Depressants D018373 - Peripheral Nervous System Agents > D009465 - Neuromuscular Agents C78281 - Agent Affecting Musculoskeletal System > C29696 - Muscle Relaxant C78272 - Agent Affecting Nervous System > C265 - Antidepressant Agent Cyclobenzaprine hydrochloride (MK130 hydrochloride) is a skeletal muscle relaxant with activity on the central nervous system.

   

(2,4,6-trimethylphenyl)methyl 2-benzamidoacetate

(2,4,6-trimethylphenyl)methyl 2-benzamidoacetate

C19H21NO3 (311.1521)


   

N-BENZYL-5-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)PYRIMIDIN-2-AMINE

N-BENZYL-5-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)PYRIMIDIN-2-AMINE

C17H22BN3O2 (311.1805)


   

5-(4-Methoxyphenyl)-3-methyl-1-oxa-3-azaspiro[5.5]undecane hydroc hloride

5-(4-Methoxyphenyl)-3-methyl-1-oxa-3-azaspiro[5.5]undecane hydroc hloride

C17H26ClNO2 (311.1652)


   

1-ethenylpyrrolidin-2-one,ethyl 2-methylprop-2-enoate,2-methylprop-2-enoic acid

1-ethenylpyrrolidin-2-one,ethyl 2-methylprop-2-enoate,2-methylprop-2-enoic acid

C16H25NO5 (311.1733)


   

Femoxetine

Femoxetine

C20H25NO2 (311.1885)


D018377 - Neurotransmitter Agents > D018490 - Serotonin Agents > D017367 - Selective Serotonin Reuptake Inhibitors D002491 - Central Nervous System Agents > D011619 - Psychotropic Drugs > D000928 - Antidepressive Agents D018377 - Neurotransmitter Agents > D014179 - Neurotransmitter Uptake Inhibitors C78272 - Agent Affecting Nervous System > C47794 - Serotonin Agonist D049990 - Membrane Transport Modulators D000890 - Anti-Infective Agents

   

4-(4-BOC-PIPERAZIN-1-YL)-3-CHLOROANILINE

4-(4-BOC-PIPERAZIN-1-YL)-3-CHLOROANILINE

C15H22ClN3O2 (311.14)


   

1-BENZYL-4-(4,4,5,5-TETRAMETHYL-[1,3,2]DIOXABOROLAN-2-YL)-1H-PYRIDIN-2-ONE

1-BENZYL-4-(4,4,5,5-TETRAMETHYL-[1,3,2]DIOXABOROLAN-2-YL)-1H-PYRIDIN-2-ONE

C18H22BNO3 (311.1693)


   

N-[(2R)-3-[[3-Fluoro-4-(4-morpholinyl)phenyl]amino]-2-hydroxypropyl]acetamide

N-[(2R)-3-[[3-Fluoro-4-(4-morpholinyl)phenyl]amino]-2-hydroxypropyl]acetamide

C15H22FN3O3 (311.1645)


   

Fomocaine

4-[3-[4-(phenoxymethyl)phenyl]propyl]morpholine

C20H25NO2 (311.1885)


C78272 - Agent Affecting Nervous System > C245 - Anesthetic Agent

   

ETHYL 2-METHYL-5-OXO-4-PHENYL-1,4,5,6,7,8-HEXAHYDRO-3-QUINOLINECARBOXYLATE

ETHYL 2-METHYL-5-OXO-4-PHENYL-1,4,5,6,7,8-HEXAHYDRO-3-QUINOLINECARBOXYLATE

C19H21NO3 (311.1521)


   

Acetamide,N-(2-chlorophenyl)-2-[[2-(diethylamino)ethyl]ethylamino]-

Acetamide,N-(2-chlorophenyl)-2-[[2-(diethylamino)ethyl]ethylamino]-

C16H26ClN3O (311.1764)


   

4-Cyano-4-n-butyl-p-terphenyl

4-Cyano-4-n-butyl-p-terphenyl

C23H21N (311.1674)


   

(3,4-DIFLUORO-PHENYL)-PIPERIDIN-4-YL-METHANONE

(3,4-DIFLUORO-PHENYL)-PIPERIDIN-4-YL-METHANONE

C18H21N3O2 (311.1634)


   

O-(tert-Butyldimethylsilyl)benzanilide

O-(tert-Butyldimethylsilyl)benzanilide

C19H25NOSi (311.1705)


   

2-(BENZYLOXY)-4-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)PYRIDINE

2-(BENZYLOXY)-4-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)PYRIDINE

C18H22BNO3 (311.1693)


   

6-Benzyloxypyridine-3-boronic acid pinacol ester

6-Benzyloxypyridine-3-boronic acid pinacol ester

C18H22BNO3 (311.1693)


   

1-(6,7-DIMETHOXY-1-PHENYL-3,4-DIHYDRO-1H-ISOQUINOLIN-2-YL)-ETHANONE

1-(6,7-DIMETHOXY-1-PHENYL-3,4-DIHYDRO-1H-ISOQUINOLIN-2-YL)-ETHANONE

C19H21NO3 (311.1521)


   

(S)-Di-tert-butyl2-cyanopiperazine-1,4-dicarboxylate

(S)-Di-tert-butyl2-cyanopiperazine-1,4-dicarboxylate

C15H25N3O4 (311.1845)


   

Ethyl 3-(dibenzylamino)-2-oxopropanoate

Ethyl 3-(dibenzylamino)-2-oxopropanoate

C19H21NO3 (311.1521)


   

3-AMINO-N,N-DIETHYL-4-PIPERIDIN-1-YL-BENZENESULFONAMIDE

3-AMINO-N,N-DIETHYL-4-PIPERIDIN-1-YL-BENZENESULFONAMIDE

C15H25N3O2S (311.1667)


   
   

ammonium tetradecyl sulphate

ammonium tetradecyl sulphate

C14H33NO4S (311.213)


   
   

Butanoic acid, 4-[bis(phenylmethyl)amino]-, ethyl ester

Butanoic acid, 4-[bis(phenylmethyl)amino]-, ethyl ester

C20H25NO2 (311.1885)


   

Trimeperidine hydrochloride

Trimeperidine hydrochloride

C17H26ClNO2 (311.1652)


   

Leonurine

Benzoic acid, 4-hydroxy-3,5-dimethoxy-, 4-((aminoiminomethyl)amino)butyl ester

C14H21N3O5 (311.1481)


Leonurine is a trihydroxybenzoic acid. Leonurine is a natural product found in Leonotis leonurus and Leonurus sibiricus with data available. Leonurine is an alkaloid isolated from Leonurus artemisia, with anti-oxidative and anti-inflammatory. Leonurine is an alkaloid isolated from Leonurus artemisia, with anti-oxidative and anti-inflammatory.

   

(2S)-1-Amino-3-{[3-fluoro-4-(4-morpholinyl)phenyl]amino}-2-propanyl acetate

(2S)-1-Amino-3-{[3-fluoro-4-(4-morpholinyl)phenyl]amino}-2-propanyl acetate

C15H22FN3O3 (311.1645)


   

(R)-(+)-N-CARBOMETHOXY-ALPHA, ALPHA-DIPHEN YL-2-PYRROLIDINEMETHANOL

(R)-(+)-N-CARBOMETHOXY-ALPHA, ALPHA-DIPHEN YL-2-PYRROLIDINEMETHANOL

C19H21NO3 (311.1521)


   

1-{4-[(2-Ethoxyethoxy)methyl]phenoxy}-3-(isopropylamino)-2-propanol

1-{4-[(2-Ethoxyethoxy)methyl]phenoxy}-3-(isopropylamino)-2-propanol

C17H29NO4 (311.2096)


   

1-Benzylpyridin-2(1H)-one-5-boronic acid pinacol ester

1-Benzylpyridin-2(1H)-one-5-boronic acid pinacol ester

C18H22BNO3 (311.1693)


   

Benzenamine, 5-chloro-2-(dodecyloxy)-

Benzenamine, 5-chloro-2-(dodecyloxy)-

C18H30ClNO (311.2016)


   

3-Oxobutanoic acid 2-[phenyl(phenylmethyl)amino]ethyl ester

3-Oxobutanoic acid 2-[phenyl(phenylmethyl)amino]ethyl ester

C19H21NO3 (311.1521)


   

trans-1-(tert-butoxycarbonyl)-4-(cyclohexylmethyl)pyrrolidine-3-carboxylic acid

trans-1-(tert-butoxycarbonyl)-4-(cyclohexylmethyl)pyrrolidine-3-carboxylic acid

C17H29NO4 (311.2096)


   

N-(furan-2-ylmethyl)-1-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]methanimine

N-(furan-2-ylmethyl)-1-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]methanimine

C18H22BNO3 (311.1693)


   

3-​Pyrrolidinecarboxyli​c acid, 4-​(3-​methoxyphenyl)​-​1-​(phenylmethyl)​-

3-​Pyrrolidinecarboxyli​c acid, 4-​(3-​methoxyphenyl)​-​1-​(phenylmethyl)​-

C19H21NO3 (311.1521)


   

2-Benzyloxypyridine-3-boronic acid pinacol ester

2-Benzyloxypyridine-3-boronic acid pinacol ester

C18H22BNO3 (311.1693)


   
   
   

2-Methoxyoestra-1,3,5(10),16-tetraene-3-carboxamide

2-Methoxyoestra-1,3,5(10),16-tetraene-3-carboxamide

C20H25NO2 (311.1885)


   

9-Butyl-8-(4-methoxybenzyl)-9H-purin-6-amine

9-Butyl-8-(4-methoxybenzyl)-9H-purin-6-amine

C17H21N5O (311.1746)


   

10H-Pyrido(3,2-b)(1,4)benzothiazine, 10-(2-piperidinoethyl)-

10H-Pyrido(3,2-b)(1,4)benzothiazine, 10-(2-piperidinoethyl)-

C18H21N3S (311.1456)


   

Benzoic acid, p-hydroxy-, (p-(diethylamino)benzylidene)hydrazide

Benzoic acid, p-hydroxy-, (p-(diethylamino)benzylidene)hydrazide

C18H21N3O2 (311.1634)


   

Val-pro-pro

Val-pro-pro

C15H25N3O4 (311.1845)


D004791 - Enzyme Inhibitors > D011480 - Protease Inhibitors > D000806 - Angiotensin-Converting Enzyme Inhibitors A tripeptide composed of L-valine and two L-proline units joined by peptide linkages. H-Val-Pro-Pro-OH, a milk-derived proline peptides derivative, is an inhibitor of Angiotensin I converting enzyme (ACE), with an IC50 of 9 μM. H-Val-Pro-Pro-OH, a milk-derived proline peptides derivative, is an inhibitor of Angiotensin I converting enzyme (ACE), with an IC50 of 9 μM. H-Val-Pro-Pro-OH, a milk-derived proline peptides derivative, is an inhibitor of Angiotensin I converting enzyme (ACE), with an IC50 of 9 μM.

   

Ambutonium

Ambutonium

C20H27N2O+ (311.2123)


C78272 - Agent Affecting Nervous System > C66880 - Anticholinergic Agent > C29704 - Antimuscarinic Agent

   

6-methyl-N,4-diphenylquinazolin-2-amine

6-methyl-N,4-diphenylquinazolin-2-amine

C21H17N3 (311.1422)


   

(R)-6-Propyl-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinoline-2,10,11-triol

(R)-6-Propyl-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinoline-2,10,11-triol

C19H21NO3 (311.1521)


   

N-[2-(2-methoxyphenoxy)ethyl]-2,3-dihydro-1H-indene-5-carboxamide

N-[2-(2-methoxyphenoxy)ethyl]-2,3-dihydro-1H-indene-5-carboxamide

C19H21NO3 (311.1521)


   

N-{(E)-[4-(dimethylamino)phenyl]methylidene}-2-(3-methylphenoxy)acetohydrazide

N-{(E)-[4-(dimethylamino)phenyl]methylidene}-2-(3-methylphenoxy)acetohydrazide

C18H21N3O2 (311.1634)


   

1-phenyl-N-(3-propan-2-yloxypropyl)-4-pyrazolo[3,4-d]pyrimidinamine

1-phenyl-N-(3-propan-2-yloxypropyl)-4-pyrazolo[3,4-d]pyrimidinamine

C17H21N5O (311.1746)


   

1,7,7-Trimethyl-4-[(2-methyl-2,3-dihydroindol-1-yl)-oxomethyl]-2-bicyclo[2.2.1]heptanone

1,7,7-Trimethyl-4-[(2-methyl-2,3-dihydroindol-1-yl)-oxomethyl]-2-bicyclo[2.2.1]heptanone

C20H25NO2 (311.1885)


   

N-[2-(3,4-Dimethoxy-phenyl)-ethyl]-3-phenyl-acrylamide

N-[2-(3,4-Dimethoxy-phenyl)-ethyl]-3-phenyl-acrylamide

C19H21NO3 (311.1521)


   

Carnequinazoline A

Carnequinazoline A

C18H21N3O2 (311.1634)


   

Wasabidienone E

Wasabidienone E

C16H25NO5 (311.1733)


   

(S)-3-Oxo-N-(2-oxotetrahydrofuran-3-yl)tridecanamide

(S)-3-Oxo-N-(2-oxotetrahydrofuran-3-yl)tridecanamide

C17H29NO4 (311.2096)


   

Pyrrobutamine

1-(4-(4-chlorophenyl)-3-phenylbut-2-enyl)pyrrolidine

C20H22ClN (311.1441)


R - Respiratory system > R06 - Antihistamines for systemic use > R06A - Antihistamines for systemic use

   

9-Butyl-8-(3-methoxybenzyl)-9H-purin-6-amine

9-Butyl-8-(3-methoxybenzyl)-9H-purin-6-amine

C17H21N5O (311.1746)


   

(2s)-2-{[3-(3-Aminophenyl)imidazo[1,2-B]pyridazin-6-Yl]amino}-3-Methylbutan-1-Ol

(2s)-2-{[3-(3-Aminophenyl)imidazo[1,2-B]pyridazin-6-Yl]amino}-3-Methylbutan-1-Ol

C17H21N5O (311.1746)


   

(2S)-4-(4-fluorobenzyl)-N-(3-sulfanylpropyl)piperazine-2-carboxamide

(2S)-4-(4-fluorobenzyl)-N-(3-sulfanylpropyl)piperazine-2-carboxamide

C15H22FN3OS (311.1468)


   

Noberastine

Noberastine

C17H21N5O (311.1746)


C308 - Immunotherapeutic Agent > C29578 - Histamine-1 Receptor Antagonist

   

1-(4-(4-chlorophenyl)-3-phenylbut-2-enyl)pyrrolidine

1-[(2E)-4-(4-chlorophenyl)-3-phenylbut-2-en-1-yl]pyrrolidine

C20H22ClN (311.1441)


R - Respiratory system > R06 - Antihistamines for systemic use > R06A - Antihistamines for systemic use

   

Butanex

Acetamide, N-(butoxymethyl)-2-chloro-N-(2,6-diethylphenyl)-

C17H26ClNO2 (311.1652)


D010575 - Pesticides > D006540 - Herbicides D009676 - Noxae > D002273 - Carcinogens D016573 - Agrochemicals

   

(Z)-1-Methyl-2-(undec-6-enyl)quinolin-4(1H)-one

(Z)-1-Methyl-2-(undec-6-enyl)quinolin-4(1H)-one

C21H29NO (311.2249)


   

13(S)-Hpode(1-)

13(S)-Hpode(1-)

C18H31O4- (311.2222)


Conjugate base of 13(S)-HPODE arising from deprotonation of the carboxylic acid function.

   

(9S,10E,12Z)-9-Hydroperoxy-10,12-octadecadienoate

(9S,10E,12Z)-9-Hydroperoxy-10,12-octadecadienoate

C18H31O4- (311.2222)


   

(8R,9Z,12Z)-8-Hydroperoxyoctadeca-9,12-dienoate

(8R,9Z,12Z)-8-Hydroperoxyoctadeca-9,12-dienoate

C18H31O4- (311.2222)


   

(11S)-11-Hydroperoxylinoleate

(11S)-11-Hydroperoxylinoleate

C18H31O4- (311.2222)


Conjugate base of (11S)-11-hydroperoxylinoleic acid arising from deprotonation of the carboxylic acid function.

   

(9R,10E,12Z)-9-hydroperoxyoctadeca-10,12-dienoate

(9R,10E,12Z)-9-hydroperoxyoctadeca-10,12-dienoate

C18H31O4- (311.2222)


   

5(S),8(R)-DiHODE(1-)

5(S),8(R)-DiHODE(1-)

C18H31O4- (311.2222)


A monocarboxylic acid anion resulting from the deprotonation of the carboxy group of 5(S),8(R)-DiHODE. The major species at pH 7.3.

   

(8E,10R,12Z)-10-Hydroperoxy-8,12-octadecadienoate

(8E,10R,12Z)-10-Hydroperoxy-8,12-octadecadienoate

C18H31O4- (311.2222)


The hydroperoxy fatty acid anion that is the conjugate base of hydroperoxy fatty acid anion, formed by deprotonation of the carboxy group; principal microspecies at pH 7.3.

   

(8E,10S,12Z)-10-hydroperoxyoctadeca-8,12-dienoate

(8E,10S,12Z)-10-hydroperoxyoctadeca-8,12-dienoate

C18H31O4- (311.2222)


An unsaturated fatty acid anion that is the conjugate base of (8E,10S,12Z)-10-hydroperoxyoctadeca-8,12-dienoic acid, obtained by deprotonation of the carboxy group.

   

(12Z,15Z)-9,10-dihydroxyoctadeca-12,15-dienoic acid

(12Z,15Z)-9,10-dihydroxyoctadeca-12,15-dienoic acid

C18H31O4- (311.2222)


   

9-Hydroxy-10-oxo-12-octadecenoate

9-Hydroxy-10-oxo-12-octadecenoate

C18H31O4- (311.2222)


   

(9Z,11E,13R)-13-hydroperoxyoctadecadienoate

(9Z,11E,13R)-13-hydroperoxyoctadecadienoate

C18H31O4- (311.2222)


   

(9Z,15Z)-12,13-Dihydroxyoctadeca-9,15-dienoate

(9Z,15Z)-12,13-Dihydroxyoctadeca-9,15-dienoate

C18H31O4- (311.2222)


   

(9Z,12Z)-15,16-Dihydroxyoctadeca-9,12-dienoate

(9Z,12Z)-15,16-Dihydroxyoctadeca-9,12-dienoate

C18H31O4- (311.2222)


   

8-[3-[(3-Pentyloxiran-2-yl)methyl]oxiran-2-yl]octanoate

8-[3-[(3-Pentyloxiran-2-yl)methyl]oxiran-2-yl]octanoate

C18H31O4- (311.2222)


   

10-oxo-13-Hydroxy-11-octadecenoate

10-oxo-13-Hydroxy-11-octadecenoate

C18H31O4- (311.2222)


   

(7S,8S,9Z,12Z)-7,8-dihydroxy-9,12-octadecadienoate

(7S,8S,9Z,12Z)-7,8-dihydroxy-9,12-octadecadienoate

C18H31O4- (311.2222)


   

(3Z)-3-(5-chloro-2-tricyclo[9.4.0.03,8]pentadeca-1(15),3(8),4,6,11,13-hexaenylidene)-N,N-dimethylpropan-1-amine

(3Z)-3-(5-chloro-2-tricyclo[9.4.0.03,8]pentadeca-1(15),3(8),4,6,11,13-hexaenylidene)-N,N-dimethylpropan-1-amine

C20H22ClN (311.1441)


   

(3,8)-Decadienoylcarnitine

(3,8)-Decadienoylcarnitine

C17H29NO4 (311.2096)


   

(2,6)-Decadienoylcarnitine

(2,6)-Decadienoylcarnitine

C17H29NO4 (311.2096)


   

(3,6)-Decadienoylcarnitine

(3,6)-Decadienoylcarnitine

C17H29NO4 (311.2096)


   

(6,8)-Decadienoylcarnitine

(6,8)-Decadienoylcarnitine

C17H29NO4 (311.2096)


   

(3,5)-Decadienoylcarnitine

(3,5)-Decadienoylcarnitine

C17H29NO4 (311.2096)


   

(2,8)-Decadienoylcarnitine

(2,8)-Decadienoylcarnitine

C17H29NO4 (311.2096)


   

(4,6)-Decadienoylcarnitine

(4,6)-Decadienoylcarnitine

C17H29NO4 (311.2096)


   

(5,8)-Decadienoylcarnitine

(5,8)-Decadienoylcarnitine

C17H29NO4 (311.2096)


   

(2,7)-Decadienoylcarnitine

(2,7)-Decadienoylcarnitine

C17H29NO4 (311.2096)


   

(4,7)-Decadienoylcarnitine

(4,7)-Decadienoylcarnitine

C17H29NO4 (311.2096)


   

(5,7)-Decadienoylcarnitine

(5,7)-Decadienoylcarnitine

C17H29NO4 (311.2096)


   

(4,8)-Decadienoylcarnitine

(4,8)-Decadienoylcarnitine

C17H29NO4 (311.2096)


   

(3,7)-Decadienoylcarnitine

(3,7)-Decadienoylcarnitine

C17H29NO4 (311.2096)


   

(2,5)-Decadienoylcarnitine

(2,5)-Decadienoylcarnitine

C17H29NO4 (311.2096)


   

Talathermophilin E

Talathermophilin E

C18H21N3O2 (311.1634)


A natural product found in Talaromyces thermophilus.

   

2-(3,4-Dimethylphenyl)-5-ethyl-5-phenyl-1,2,4-triazolidine-3-thione

2-(3,4-Dimethylphenyl)-5-ethyl-5-phenyl-1,2,4-triazolidine-3-thione

C18H21N3S (311.1456)


   

1-(4-Morpholinyl)-2-(4-phenylphenoxy)-1-propanone

1-(4-Morpholinyl)-2-(4-phenylphenoxy)-1-propanone

C19H21NO3 (311.1521)


   

N-[(3R)-1-azabicyclo[2.2.2]octan-3-yl]-2-(1-methyl-3-indolyl)-2-oxoacetamide

N-[(3R)-1-azabicyclo[2.2.2]octan-3-yl]-2-(1-methyl-3-indolyl)-2-oxoacetamide

C18H21N3O2 (311.1634)


   

13-HPODE(1-)

13-HPODE(1-)

C18H31O4- (311.2222)


A hydroperoxy fatty acid anion that is the conjugate base of 13-HPODE arising from deprotonation of the carboxylic acid function; major species at pH 7.3.

   

N-[2-(2-fluorophenyl)ethyl]-5,6,7,8-tetrahydro-[1,2,4]triazolo[5,1-b]quinazolin-9-amine

N-[2-(2-fluorophenyl)ethyl]-5,6,7,8-tetrahydro-[1,2,4]triazolo[5,1-b]quinazolin-9-amine

C17H18FN5 (311.1546)


   

3-(((4-(2-Methoxyphenyl)-1-piperazinyl)imino)methyl)phenol

3-(((4-(2-Methoxyphenyl)-1-piperazinyl)imino)methyl)phenol

C18H21N3O2 (311.1634)


   

9-hydroperoxy-(10E,12Z)-octadecadienoate

9-hydroperoxy-(10E,12Z)-octadecadienoate

C18H31O4- (311.2222)


   

(17

A)-17-Hydroxy-3-oxo-19-norpregna-5(10),9(11)-diene-21-nitrile

C20H25NO2 (311.1885)


   

6-ethyl-N-[2-(4-methoxyphenyl)ethyl]-5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine

6-ethyl-N-[2-(4-methoxyphenyl)ethyl]-5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine

C17H21N5O (311.1746)


   

2-Methoxy-6-[[(1-propyl-5-benzimidazolyl)amino]methyl]phenol

2-Methoxy-6-[[(1-propyl-5-benzimidazolyl)amino]methyl]phenol

C18H21N3O2 (311.1634)


   

9-[2-(1H-benzimidazol-2-yl)ethyl]carbazole

9-[2-(1H-benzimidazol-2-yl)ethyl]carbazole

C21H17N3 (311.1422)


   

7(S),8(S)-DiHODE(1-)

7(S),8(S)-DiHODE(1-)

C18H31O4- (311.2222)


Conjugate base of 7(S),8(S)-DiHODE arising from deprotonation of the carboxylic acid function.

   

(2-Nitro-benzylidene)-(4-pyridin-2-yl-piperazin-1-yl)-amine

(2-Nitro-benzylidene)-(4-pyridin-2-yl-piperazin-1-yl)-amine

C16H17N5O2 (311.1382)


   

N-[4-[[(3,4-dimethylanilino)-oxomethyl]amino]phenyl]-N-methylacetamide

N-[4-[[(3,4-dimethylanilino)-oxomethyl]amino]phenyl]-N-methylacetamide

C18H21N3O2 (311.1634)


   

3-Chloro-1-cyclohexyl-4-(4-methyl-1-piperazinyl)pyrrole-2,5-dione

3-Chloro-1-cyclohexyl-4-(4-methyl-1-piperazinyl)pyrrole-2,5-dione

C15H22ClN3O2 (311.14)


   

1-(1-Methylcyclopentyl)-1-phenyl-4-(1-piperidinyl)-2-butyn-1-ol

1-(1-Methylcyclopentyl)-1-phenyl-4-(1-piperidinyl)-2-butyn-1-ol

C21H29NO (311.2249)


   

4-(dimethylamino)-N-[1-(3-methoxyphenyl)ethylidene]benzohydrazide

4-(dimethylamino)-N-[1-(3-methoxyphenyl)ethylidene]benzohydrazide

C18H21N3O2 (311.1634)


   

3-(4-Ethyl-1-piperazinyl)-5-methylpyridazino[3,4-b][1,4]benzoxazine

3-(4-Ethyl-1-piperazinyl)-5-methylpyridazino[3,4-b][1,4]benzoxazine

C17H21N5O (311.1746)


   

11-hydroxy-(12S,13S)-epoxy-(9Z)-octadecenoate(1-)

11-hydroxy-(12S,13S)-epoxy-(9Z)-octadecenoate(1-)

C18H31O4- (311.2222)


A monounsaturated fatty acid anion that is the conjugate base of 11-hydroxy-(12S,13S)-epoxy-(9Z)-octadecenoic acid, obtained by deprotonation of the carboxy group; major species at pH 7.3.

   

1-(4-methylphenyl)ethanone N-(2-phenylethyl)thiosemicarbazone

1-(4-methylphenyl)ethanone N-(2-phenylethyl)thiosemicarbazone

C18H21N3S (311.1456)


   

2-[(E)-[4-(Dimethylamino)phenyl]methylideneamino]oxy-N-(4-methylphenyl)acetamide

2-[(E)-[4-(Dimethylamino)phenyl]methylideneamino]oxy-N-(4-methylphenyl)acetamide

C18H21N3O2 (311.1634)


   

(11R)-hydroperoxy-(9Z,12Z)-octadecadienoate

(11R)-hydroperoxy-(9Z,12Z)-octadecadienoate

C18H31O4- (311.2222)


   

(2R,9Z,12Z)-2-hydroperoxyoctadecadienoate

(2R,9Z,12Z)-2-hydroperoxyoctadecadienoate

C18H31O4- (311.2222)


   

8-{3-[(2Z)-8-hydroxyoct-2-en-1-yl]oxiran-2-yl}octanoate

8-{3-[(2Z)-8-hydroxyoct-2-en-1-yl]oxiran-2-yl}octanoate

C18H31O4- (311.2222)


   

(9Z)-11-[3-(5-hydroxypentyl)oxiran-2-yl]undec-9-enoate

(9Z)-11-[3-(5-hydroxypentyl)oxiran-2-yl]undec-9-enoate

C18H31O4- (311.2222)


   
   
   
   

3-(4-Chlorophenyl)-1-(4-morpholinyl)-3-heptanol

3-(4-Chlorophenyl)-1-(4-morpholinyl)-3-heptanol

C17H26ClNO2 (311.1652)


   

4-(4-phenylmethoxyphenoxy)-N-prop-2-enyl-1-butanamine

4-(4-phenylmethoxyphenoxy)-N-prop-2-enyl-1-butanamine

C20H25NO2 (311.1885)


   

N4-methylantirhine

N4-methylantirhine

C20H27N2O+ (311.2123)


   

Ibogaine(1+)

Ibogaine(1+)

C20H27N2O+ (311.2123)


A tertiary ammonium ion resulting from the protonation of the tertiary amino group of ibogaine.

   

1-[(1S,4S)-2-bicyclo[2.2.1]hept-5-enyl]-1-phenyl-3-piperidin-1-ylpropan-1-ol

1-[(1S,4S)-2-bicyclo[2.2.1]hept-5-enyl]-1-phenyl-3-piperidin-1-ylpropan-1-ol

C21H29NO (311.2249)


   

(4S)-4-[(2E,4Z)-2,4-Decadienoyloxy]-4-(trimethylammonio)butanoate

(4S)-4-[(2E,4Z)-2,4-Decadienoyloxy]-4-(trimethylammonio)butanoate

C17H29NO4 (311.2096)


   

1-[(2S,3R,6S)-6-(2-aminoethyl)-2-(hydroxymethyl)-3-oxanyl]-3-(4-fluorophenyl)urea

1-[(2S,3R,6S)-6-(2-aminoethyl)-2-(hydroxymethyl)-3-oxanyl]-3-(4-fluorophenyl)urea

C15H22FN3O3 (311.1645)


   

1-[(2R,3S,6S)-6-(2-aminoethyl)-2-(hydroxymethyl)-3-oxanyl]-3-(4-fluorophenyl)urea

1-[(2R,3S,6S)-6-(2-aminoethyl)-2-(hydroxymethyl)-3-oxanyl]-3-(4-fluorophenyl)urea

C15H22FN3O3 (311.1645)


   

1-[(2R,3R,6S)-6-(2-aminoethyl)-2-(hydroxymethyl)-3-oxanyl]-3-(4-fluorophenyl)urea

1-[(2R,3R,6S)-6-(2-aminoethyl)-2-(hydroxymethyl)-3-oxanyl]-3-(4-fluorophenyl)urea

C15H22FN3O3 (311.1645)


   

1-[(2R,3S,6R)-6-(2-aminoethyl)-2-(hydroxymethyl)-3-oxanyl]-3-(4-fluorophenyl)urea

1-[(2R,3S,6R)-6-(2-aminoethyl)-2-(hydroxymethyl)-3-oxanyl]-3-(4-fluorophenyl)urea

C15H22FN3O3 (311.1645)


   

1-[(2R,3R,6R)-6-(2-aminoethyl)-2-(hydroxymethyl)-3-oxanyl]-3-(4-fluorophenyl)urea

1-[(2R,3R,6R)-6-(2-aminoethyl)-2-(hydroxymethyl)-3-oxanyl]-3-(4-fluorophenyl)urea

C15H22FN3O3 (311.1645)


   

1-[(2S,3R,6R)-6-(2-aminoethyl)-2-(hydroxymethyl)-3-oxanyl]-3-(4-fluorophenyl)urea

1-[(2S,3R,6R)-6-(2-aminoethyl)-2-(hydroxymethyl)-3-oxanyl]-3-(4-fluorophenyl)urea

C15H22FN3O3 (311.1645)


   

1-[(2S,3S,6S)-6-(2-aminoethyl)-2-(hydroxymethyl)-3-oxanyl]-3-(4-fluorophenyl)urea

1-[(2S,3S,6S)-6-(2-aminoethyl)-2-(hydroxymethyl)-3-oxanyl]-3-(4-fluorophenyl)urea

C15H22FN3O3 (311.1645)


   

1-[(2S,3S,6R)-6-(2-aminoethyl)-2-(hydroxymethyl)-3-oxanyl]-3-(4-fluorophenyl)urea

1-[(2S,3S,6R)-6-(2-aminoethyl)-2-(hydroxymethyl)-3-oxanyl]-3-(4-fluorophenyl)urea

C15H22FN3O3 (311.1645)


   
   
   
   
   
   

(3S,4S,5R,6R)-3-hydroxy-6-methoxy-1-methyl-4,5-diphenylpiperidin-2-one

(3S,4S,5R,6R)-3-hydroxy-6-methoxy-1-methyl-4,5-diphenylpiperidin-2-one

C19H21NO3 (311.1521)


   

N-butyl-N(2)-[(2Z)-2-(2-furyl)-2-(methoxyimino)acetyl]-L-serinamide

N-butyl-N(2)-[(2Z)-2-(2-furyl)-2-(methoxyimino)acetyl]-L-serinamide

C14H21N3O5 (311.1481)


   

(2S)-2-Amino-N-(2,6-dimethylphenyl)-N-[3-(3-pyridinyl)propyl]propanamide

(2S)-2-Amino-N-(2,6-dimethylphenyl)-N-[3-(3-pyridinyl)propyl]propanamide

C19H25N3O (311.1998)


   

7,8-dihydroxy-(9Z,12Z)-octadecadienoate

7,8-dihydroxy-(9Z,12Z)-octadecadienoate

C18H31O4- (311.2222)


   

1-(4-Fluorophenyl)-2-phenyl-3-(1-piperidinyl)-1-propanone

1-(4-Fluorophenyl)-2-phenyl-3-(1-piperidinyl)-1-propanone

C20H22FNO (311.1685)


   

(5S)-hydroperoxy-(6E,8Z)-octadecadienoate

(5S)-hydroperoxy-(6E,8Z)-octadecadienoate

C18H31O4- (311.2222)


   

N-ethyl-N-(3-methylphenyl)-N-(7H-purin-1-ium-6-yl)propane-1,3-diamine

N-ethyl-N-(3-methylphenyl)-N-(7H-purin-1-ium-6-yl)propane-1,3-diamine

C17H23N6+ (311.1984)


   

(10R,11R)-epoxy-(9S)-hydroxy-(12Z)-octadecenoate

(10R,11R)-epoxy-(9S)-hydroxy-(12Z)-octadecenoate

C18H31O4- (311.2222)


   

(12S,13R)-epoxy-(10R)-hydroxy-(8E)-octadecenoate

(12S,13R)-epoxy-(10R)-hydroxy-(8E)-octadecenoate

C18H31O4- (311.2222)


   

(12R,13R)-epoxy-(11S)-hydroxy-(9Z)-octadecenoate

(12R,13R)-epoxy-(11S)-hydroxy-(9Z)-octadecenoate

C18H31O4- (311.2222)


   

(2S)-2-amino-N-[(2S)-1-oxo-1-[2-(2,4,5-trihydroxyphenyl)ethylamino]propan-2-yl]propanamide

(2S)-2-amino-N-[(2S)-1-oxo-1-[2-(2,4,5-trihydroxyphenyl)ethylamino]propan-2-yl]propanamide

C14H21N3O5 (311.1481)


   

(3S)-3-[(2E,4Z)-deca-2,4-dienoyl]oxy-4-(trimethylazaniumyl)butanoate

(3S)-3-[(2E,4Z)-deca-2,4-dienoyl]oxy-4-(trimethylazaniumyl)butanoate

C17H29NO4 (311.2096)


   

(5S,18)-dihydroxy-(6E,8Z)-octadecadienoate

(5S,18)-dihydroxy-(6E,8Z)-octadecadienoate

C18H31O4- (311.2222)


   

(11S)-hydroxy-(9S,10S)-epoxy-(12Z)-octadecenoate

(11S)-hydroxy-(9S,10S)-epoxy-(12Z)-octadecenoate

C18H31O4- (311.2222)


   

(12S,13S)-epoxy-(11R)-hydroxy-(9Z)-octadecenoate

(12S,13S)-epoxy-(11R)-hydroxy-(9Z)-octadecenoate

C18H31O4- (311.2222)


   

(11R)-hydroxy-(9S,10S)-epoxy-(12Z)-octadecenoate

(11R)-hydroxy-(9S,10S)-epoxy-(12Z)-octadecenoate

C18H31O4- (311.2222)


   

11-Hydroxy-12,13-epoxy-(9cis)-octadecenoate

11-Hydroxy-12,13-epoxy-(9cis)-octadecenoate

C18H31O4- (311.2222)


   

2-[(8S,13R,14S,17R)-17-hydroxy-13-methyl-3-oxo-1,2,6,7,8,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-17-yl]acetonitrile

2-[(8S,13R,14S,17R)-17-hydroxy-13-methyl-3-oxo-1,2,6,7,8,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-17-yl]acetonitrile

C20H25NO2 (311.1885)


   

(+)-Pronuciferine

(+)-Pronuciferine

C19H21NO3 (311.1521)


An isoquinoline alkaloid isolated from Berberis coletioides.

   

Butachlore

Butachlore

C17H26ClNO2 (311.1652)


D010575 - Pesticides > D006540 - Herbicides D009676 - Noxae > D002273 - Carcinogens D016573 - Agrochemicals

   

9(S)-HPODE(1-)

9(S)-HPODE(1-)

C18H31O4 (311.2222)


A monocarboxylic acid anion obtained by removal of a proton from the carboxylic acid group of 9(S)-HPODE.

   

8(R)-HPODE(1-)

8(R)-HPODE(1-)

C18H31O4 (311.2222)


A monocarboxylic acid anion resulting from the deprotonation of the carboxy group of 8(R)-HPODE. The major species at pH 7.3.

   

9(R)-HPODE(1-)

9(R)-HPODE(1-)

C18H31O4 (311.2222)


A monocarboxylic acid anion obtained by removal of a proton from the carboxylic acid group of 9(R)-HPODE.

   

13(R)-HPODE(1-)

13(R)-HPODE(1-)

C18H31O4 (311.2222)


A 13-HPODE(1-) that is the conjugate base of 13(R)-HPODE, obtained by deprotonation of the carboxylic acid function. Major microspecies at pH 7.3.

   

Arginyl-histidine

Arginyl-histidine

C12H21N7O3 (311.1706)


   

(2E,4Z)-decadienoylcarnitine

(2E,4Z)-decadienoylcarnitine

C17H29NO4 (311.2096)


An O-acylcarnitine having (2E,4Z)-decadienoyl as the acyl substituent.

   
   

3-Hydroxy-6-methoxy-1-methyl-4,5-diphenyl-2-piperidinone

3-Hydroxy-6-methoxy-1-methyl-4,5-diphenyl-2-piperidinone

C19H21NO3 (311.1521)


A member of the class of piperidones that is 1-methylpiperidin-2-one in which a hydrogen at positions 3,4,5 and 6 has been replaced by hydroxy, phenyl, phenyl and methoxy groups, respectively.

   

(8R)-7-propyl-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinoline-2,13,14-triol

(8R)-7-propyl-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinoline-2,13,14-triol

C19H21NO3 (311.1521)


   

arginylhistidine

arginylhistidine

C12H21N7O3 (311.1706)


   

Histidylarginine

Histidylarginine

C12H21N7O3 (311.1706)


   

O-decadienoylcarnitine

O-decadienoylcarnitine

C17H29NO4 (311.2096)


An O-acylcarnitine in which the acyl group specified is decadienoyl in which the positions of the double bonds is unspecified..

   

O-decadienoyl-L-carnitine

O-decadienoyl-L-carnitine

C17H29NO4 (311.2096)


An O-acyl-L-carnitine that is L-carnitine having decadienoyl group as the acyl substituent in which the positions of the two double bonds are unspecified.

   

(12s,15r,16s,17r)-11,11,15-trimethyl-10,19-dioxa-2-azapentacyclo[14.2.1.0³,⁸.0⁹,¹⁸.0¹²,¹⁷]nonadeca-1,3,5,7,9(18)-pentaen-15-ol

(12s,15r,16s,17r)-11,11,15-trimethyl-10,19-dioxa-2-azapentacyclo[14.2.1.0³,⁸.0⁹,¹⁸.0¹²,¹⁷]nonadeca-1,3,5,7,9(18)-pentaen-15-ol

C19H21NO3 (311.1521)


   

(12br)-10,11-dimethoxy-7,8,12b,13-tetrahydro-5h-6-azatetraphen-2-ol

(12br)-10,11-dimethoxy-7,8,12b,13-tetrahydro-5h-6-azatetraphen-2-ol

C19H21NO3 (311.1521)


   

2-[(2e)-1-hydroxy-3,7-dimethylocta-2,6-dien-1-yl]-1-methylquinolin-4-one

2-[(2e)-1-hydroxy-3,7-dimethylocta-2,6-dien-1-yl]-1-methylquinolin-4-one

C20H25NO2 (311.1885)


   

(1r)-2-[(2-hydroxyethyl)amino]-4-methoxy-1,5-dimethyl-6-oxocyclohexa-2,4-dien-1-yl (2r)-2-methylbutanoate

(1r)-2-[(2-hydroxyethyl)amino]-4-methoxy-1,5-dimethyl-6-oxocyclohexa-2,4-dien-1-yl (2r)-2-methylbutanoate

C16H25NO5 (311.1733)


   

(-)-pronuciferine

(-)-pronuciferine

C19H21NO3 (311.1521)


   
   

(5s,12bs)-10-methoxy-5-methyl-7,8,12b,13-tetrahydro-5h-6-azatetraphene-2,11-diol

(5s,12bs)-10-methoxy-5-methyl-7,8,12b,13-tetrahydro-5h-6-azatetraphene-2,11-diol

C19H21NO3 (311.1521)


   

3,15-dimethoxy-10-methyl-10-azatetracyclo[7.7.1.0²,⁷.0¹³,¹⁷]heptadeca-1(16),2(7),3,5,13(17),14-hexaen-16-ol

3,15-dimethoxy-10-methyl-10-azatetracyclo[7.7.1.0²,⁷.0¹³,¹⁷]heptadeca-1(16),2(7),3,5,13(17),14-hexaen-16-ol

C19H21NO3 (311.1521)


   

(6s)-6-hydroxy-5-[(2-hydroxyethyl)amino]-3-methoxy-2,6-dimethyl-4-[(2r)-2-methylbutanoyl]cyclohexa-2,4-dien-1-one

(6s)-6-hydroxy-5-[(2-hydroxyethyl)amino]-3-methoxy-2,6-dimethyl-4-[(2r)-2-methylbutanoyl]cyclohexa-2,4-dien-1-one

C16H25NO5 (311.1733)


   

(1s,5s,8r,9s,11r,13r,14r,16s,17r,18s)-13-hydroxy-5-methyl-12-methylidene-7-azaheptacyclo[9.6.2.0¹,⁸.0⁵,¹⁷.0⁷,¹⁶.0⁹,¹⁴.0¹⁴,¹⁸]nonadecan-19-one

(1s,5s,8r,9s,11r,13r,14r,16s,17r,18s)-13-hydroxy-5-methyl-12-methylidene-7-azaheptacyclo[9.6.2.0¹,⁸.0⁵,¹⁷.0⁷,¹⁶.0⁹,¹⁴.0¹⁴,¹⁸]nonadecan-19-one

C20H25NO2 (311.1885)


   

4,15-dimethoxy-10-methyl-10-azatetracyclo[7.7.1.0²,⁷.0¹³,¹⁷]heptadeca-1(16),2(7),3,5,13(17),14-hexaen-3-ol

4,15-dimethoxy-10-methyl-10-azatetracyclo[7.7.1.0²,⁷.0¹³,¹⁷]heptadeca-1(16),2(7),3,5,13(17),14-hexaen-3-ol

C19H21NO3 (311.1521)


   

16-hydroxy-5-methyl-12-methylidene-7-azaheptacyclo[9.6.2.0¹,⁸.0⁵,¹⁷.0⁷,¹⁶.0⁹,¹⁴.0¹⁴,¹⁸]nonadecan-19-one

16-hydroxy-5-methyl-12-methylidene-7-azaheptacyclo[9.6.2.0¹,⁸.0⁵,¹⁷.0⁷,¹⁶.0⁹,¹⁴.0¹⁴,¹⁸]nonadecan-19-one

C20H25NO2 (311.1885)


   

1-methyl-2-(5-undecenyl)-4(1h)-quinolinone

NA

C21H29NO (311.2249)


{"Ingredient_id": "HBIN002732","Ingredient_name": "1-methyl-2-(5-undecenyl)-4(1h)-quinolinone","Alias": "NA","Ingredient_formula": "C21H29NO","Ingredient_Smile": "NA","Ingredient_weight": "311.466","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "NA","TCMSP_id": "NA","TCM_ID_id": "9165","PubChem_id": "NA","DrugBank_id": "NA"}

   

1-methyl-2-(6-undecenyl)-4(1h)-quinolinone

NA

C21H29NO (311.2249)


{"Ingredient_id": "HBIN002735","Ingredient_name": "1-methyl-2-(6-undecenyl)-4(1h)-quinolinone","Alias": "NA","Ingredient_formula": "C21H29NO","Ingredient_Smile": "NA","Ingredient_weight": "311.466","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "NA","TCMSP_id": "NA","TCM_ID_id": "9162","PubChem_id": "NA","DrugBank_id": "NA"}

   

n-carbamimidoyl-4-hydroxy-n-(4-hydroxybutyl)-3,5-dimethoxybenzamide

n-carbamimidoyl-4-hydroxy-n-(4-hydroxybutyl)-3,5-dimethoxybenzamide

C14H21N3O5 (311.1481)


   

axinisothiocyanate h

axinisothiocyanate h

C16H25NO3S (311.1555)


   

2,2-dimethyl-8-[(3-methylbut-2-en-1-yl)oxy]pyrano[3,2-c]quinolin-5-ol

2,2-dimethyl-8-[(3-methylbut-2-en-1-yl)oxy]pyrano[3,2-c]quinolin-5-ol

C19H21NO3 (311.1521)


   

(5r,12bs)-10-methoxy-5-methyl-7,8,12b,13-tetrahydro-5h-6-azatetraphene-4,11-diol

(5r,12bs)-10-methoxy-5-methyl-7,8,12b,13-tetrahydro-5h-6-azatetraphene-4,11-diol

C19H21NO3 (311.1521)


   

(9s)-3,15-dimethoxy-10-methyl-10-azatetracyclo[7.7.1.0²,⁷.0¹³,¹⁷]heptadeca-1(16),2(7),3,5,13(17),14-hexaen-16-ol

(9s)-3,15-dimethoxy-10-methyl-10-azatetracyclo[7.7.1.0²,⁷.0¹³,¹⁷]heptadeca-1(16),2(7),3,5,13(17),14-hexaen-16-ol

C19H21NO3 (311.1521)


   

(9r)-15,16-dimethoxy-10-methyl-10-azatetracyclo[7.7.1.0²,⁷.0¹³,¹⁷]heptadeca-1(16),2,4,6,13(17),14-hexaen-4-ol

(9r)-15,16-dimethoxy-10-methyl-10-azatetracyclo[7.7.1.0²,⁷.0¹³,¹⁷]heptadeca-1(16),2,4,6,13(17),14-hexaen-4-ol

C19H21NO3 (311.1521)


   

6,13-dimethyl-7-azapentacyclo[10.8.0.0²,⁹.0⁵,⁹.0¹³,¹⁸]icosa-14,17-dien-16-one

6,13-dimethyl-7-azapentacyclo[10.8.0.0²,⁹.0⁵,⁹.0¹³,¹⁸]icosa-14,17-dien-16-one

C21H29NO (311.2249)


   

(4s,7r)-n-[(1s)-1-hydroxyethyl]-6-methyl-6,11-diazatetracyclo[7.6.1.0²,⁷.0¹²,¹⁶]hexadeca-1(16),2,9,12,14-pentaene-4-carboximidic acid

(4s,7r)-n-[(1s)-1-hydroxyethyl]-6-methyl-6,11-diazatetracyclo[7.6.1.0²,⁷.0¹²,¹⁶]hexadeca-1(16),2,9,12,14-pentaene-4-carboximidic acid

C18H21N3O2 (311.1634)


   

(1s,5r,8r,9s,10r,11s,14s,16s,17r,18r)-10-hydroxy-5-methyl-12-methylidene-7-azaheptacyclo[9.6.2.0¹,⁸.0⁵,¹⁷.0⁷,¹⁶.0⁹,¹⁴.0¹⁴,¹⁸]nonadecan-19-one

(1s,5r,8r,9s,10r,11s,14s,16s,17r,18r)-10-hydroxy-5-methyl-12-methylidene-7-azaheptacyclo[9.6.2.0¹,⁸.0⁵,¹⁷.0⁷,¹⁶.0⁹,¹⁴.0¹⁴,¹⁸]nonadecan-19-one

C20H25NO2 (311.1885)


   

3-{[2-(2-methylbut-3-en-2-yl)-1h-indol-3-yl]methyl}-3,6-dihydropyrazine-2,5-diol

3-{[2-(2-methylbut-3-en-2-yl)-1h-indol-3-yl]methyl}-3,6-dihydropyrazine-2,5-diol

C18H21N3O2 (311.1634)


   

(1s,20s)-20-methoxy-5,7-dioxa-14-azapentacyclo[12.7.0.0¹,¹⁷.0²,¹⁰.0⁴,⁸]henicosa-2,4(8),9,16,18-pentaene

(1s,20s)-20-methoxy-5,7-dioxa-14-azapentacyclo[12.7.0.0¹,¹⁷.0²,¹⁰.0⁴,⁸]henicosa-2,4(8),9,16,18-pentaene

C19H21NO3 (311.1521)


   

7-(2h-1,3-benzodioxol-5-yl)-1-(piperidin-1-yl)hepta-2,4,6-trien-1-one

7-(2h-1,3-benzodioxol-5-yl)-1-(piperidin-1-yl)hepta-2,4,6-trien-1-one

C19H21NO3 (311.1521)


   

10-methoxy-5-methyl-7,8,12b,13-tetrahydro-5h-6-azatetraphene-2,11-diol

10-methoxy-5-methyl-7,8,12b,13-tetrahydro-5h-6-azatetraphene-2,11-diol

C19H21NO3 (311.1521)


   

3-(12-carboxy-1-hydroxydodecyl)-2-isocyano-2-methyloxirane

3-(12-carboxy-1-hydroxydodecyl)-2-isocyano-2-methyloxirane

C17H29NO4 (311.2096)


   

1-methyl-3,3-bis(3-methylbut-2-en-1-yl)quinoline-2,4-dione

1-methyl-3,3-bis(3-methylbut-2-en-1-yl)quinoline-2,4-dione

C20H25NO2 (311.1885)


   

(4r,7r)-n-(1-hydroxyethyl)-6-methyl-6,11-diazatetracyclo[7.6.1.0²,⁷.0¹²,¹⁶]hexadeca-1(16),2,9,12,14-pentaene-4-carboximidic acid

(4r,7r)-n-(1-hydroxyethyl)-6-methyl-6,11-diazatetracyclo[7.6.1.0²,⁷.0¹²,¹⁶]hexadeca-1(16),2,9,12,14-pentaene-4-carboximidic acid

C18H21N3O2 (311.1634)


   

(4r,6r,10s)-15-hydroxy-6-isopropyl-10-methyl-5-oxa-16-azapentacyclo[8.6.1.0²,⁷.0⁴,⁶.0¹⁴,¹⁷]heptadeca-1,7,14(17),15-tetraen-3-one

(4r,6r,10s)-15-hydroxy-6-isopropyl-10-methyl-5-oxa-16-azapentacyclo[8.6.1.0²,⁷.0⁴,⁶.0¹⁴,¹⁷]heptadeca-1,7,14(17),15-tetraen-3-one

C19H21NO3 (311.1521)


   

(1r,5s,13s)-10,14-dimethoxy-4-methyl-12-oxa-4-azapentacyclo[9.6.1.0¹,¹³.0⁵,¹⁷.0⁷,¹⁸]octadeca-7,9,11(18),14,16-pentaene

(1r,5s,13s)-10,14-dimethoxy-4-methyl-12-oxa-4-azapentacyclo[9.6.1.0¹,¹³.0⁵,¹⁷.0⁷,¹⁸]octadeca-7,9,11(18),14,16-pentaene

C19H21NO3 (311.1521)


   

(5s,7r,7ar)-2-(2,4-dihydroxybutyl)-3-imino-5-(2-methylprop-1-en-1-yl)-tetrahydro-1h-pyrrolo[1,2-c]imidazole-7-carboxylic acid

(5s,7r,7ar)-2-(2,4-dihydroxybutyl)-3-imino-5-(2-methylprop-1-en-1-yl)-tetrahydro-1h-pyrrolo[1,2-c]imidazole-7-carboxylic acid

C15H25N3O4 (311.1845)


   

6-hydroxy-4,5,6-trimethyl-2,8-dioxa-13-azatricyclo[8.5.1.0¹³,¹⁶]hexadecane-3,7-dione

6-hydroxy-4,5,6-trimethyl-2,8-dioxa-13-azatricyclo[8.5.1.0¹³,¹⁶]hexadecane-3,7-dione

C16H25NO5 (311.1733)


   

10,11-dimethoxy-7,8,12b,13-tetrahydro-5h-6-azatetraphen-2-ol

10,11-dimethoxy-7,8,12b,13-tetrahydro-5h-6-azatetraphen-2-ol

C19H21NO3 (311.1521)


   

4,16-dimethoxy-10-methyl-10-azatetracyclo[7.7.1.0²,⁷.0¹³,¹⁷]heptadeca-1(16),2,4,6,13(17),14-hexaen-3-ol

4,16-dimethoxy-10-methyl-10-azatetracyclo[7.7.1.0²,⁷.0¹³,¹⁷]heptadeca-1(16),2,4,6,13(17),14-hexaen-3-ol

C19H21NO3 (311.1521)


   

2-[(1s,2e)-1-hydroxy-3,7-dimethylocta-2,6-dien-1-yl]-1-methylquinolin-4-one

2-[(1s,2e)-1-hydroxy-3,7-dimethylocta-2,6-dien-1-yl]-1-methylquinolin-4-one

C20H25NO2 (311.1885)


   

(2r,3r)-3-[(1r)-12-carboxy-1-hydroxydodecyl]-2-isocyano-2-methyloxirane

(2r,3r)-3-[(1r)-12-carboxy-1-hydroxydodecyl]-2-isocyano-2-methyloxirane

C17H29NO4 (311.2096)


   

4,9-dimethyl-6-(6-methylhept-5-en-2-yl)-6h,7h,8h,9h-naphtho[2,1-d][1,3]oxazole

4,9-dimethyl-6-(6-methylhept-5-en-2-yl)-6h,7h,8h,9h-naphtho[2,1-d][1,3]oxazole

C21H29NO (311.2249)


   

4,15-dimethoxy-10-methyl-10-azatetracyclo[7.7.1.0²,⁷.0¹³,¹⁷]heptadeca-1(16),2,4,6,13(17),14-hexaen-16-ol

4,15-dimethoxy-10-methyl-10-azatetracyclo[7.7.1.0²,⁷.0¹³,¹⁷]heptadeca-1(16),2,4,6,13(17),14-hexaen-16-ol

C19H21NO3 (311.1521)


   

2-[(1e)-3-hydroxy-3,7-dimethylocta-1,6-dien-1-yl]-1-methylquinolin-4-one

2-[(1e)-3-hydroxy-3,7-dimethylocta-1,6-dien-1-yl]-1-methylquinolin-4-one

C20H25NO2 (311.1885)


   

2-[(2-hydroxyethyl)amino]-4-methoxy-1,5-dimethyl-6-oxocyclohexa-2,4-dien-1-yl 2-methylbutanoate

2-[(2-hydroxyethyl)amino]-4-methoxy-1,5-dimethyl-6-oxocyclohexa-2,4-dien-1-yl 2-methylbutanoate

C16H25NO5 (311.1733)


   

10-hydroxy-5-methyl-12-methylidene-7-azaheptacyclo[9.6.2.0¹,⁸.0⁵,¹⁷.0⁷,¹⁶.0⁹,¹⁴.0¹⁴,¹⁸]nonadecan-19-one

10-hydroxy-5-methyl-12-methylidene-7-azaheptacyclo[9.6.2.0¹,⁸.0⁵,¹⁷.0⁷,¹⁶.0⁹,¹⁴.0¹⁴,¹⁸]nonadecan-19-one

C20H25NO2 (311.1885)


   

n-allylnormorphine

n-allylnormorphine

C19H21NO3 (311.1521)


   

[(1s,7s,7as)-7-hydroxy-hexahydro-1h-pyrrolizin-1-yl]methyl 3-methyl-2-(propanoyloxy)but-2-enoate

[(1s,7s,7as)-7-hydroxy-hexahydro-1h-pyrrolizin-1-yl]methyl 3-methyl-2-(propanoyloxy)but-2-enoate

C16H25NO5 (311.1733)


   

(3e,5e,7e,11e,13z,15e,17e)-19-methyl-1-azacycloicosa-1,3,5,7,11,13,15,17-octaene-2,10-diol

(3e,5e,7e,11e,13z,15e,17e)-19-methyl-1-azacycloicosa-1,3,5,7,11,13,15,17-octaene-2,10-diol

C20H25NO2 (311.1885)


   

10,14-dimethoxy-4-methyl-12-oxa-4-azapentacyclo[9.6.1.0¹,¹³.0⁵,¹⁷.0⁷,¹⁸]octadeca-7,9,11(18),14,16-pentaene

10,14-dimethoxy-4-methyl-12-oxa-4-azapentacyclo[9.6.1.0¹,¹³.0⁵,¹⁷.0⁷,¹⁸]octadeca-7,9,11(18),14,16-pentaene

C19H21NO3 (311.1521)


   

15,16-dimethoxy-10-methyl-10-azatetracyclo[7.7.1.0²,⁷.0¹³,¹⁷]heptadeca-1(16),2,4,6,13(17),14-hexaen-14-ol

15,16-dimethoxy-10-methyl-10-azatetracyclo[7.7.1.0²,⁷.0¹³,¹⁷]heptadeca-1(16),2,4,6,13(17),14-hexaen-14-ol

C19H21NO3 (311.1521)


   

(2s,3s)-2-[(2e)-but-2-en-2-yl]-3-(hydroxymethyl)-3-methyl-7-phenyl-2h-furo[3,2-c]pyridin-4-ol

(2s,3s)-2-[(2e)-but-2-en-2-yl]-3-(hydroxymethyl)-3-methyl-7-phenyl-2h-furo[3,2-c]pyridin-4-ol

C19H21NO3 (311.1521)


   

5,15-dimethoxy-10-methyl-10-azatetracyclo[7.7.1.0²,⁷.0¹³,¹⁷]heptadeca-1(16),2,4,6,13(17),14-hexaen-16-ol

5,15-dimethoxy-10-methyl-10-azatetracyclo[7.7.1.0²,⁷.0¹³,¹⁷]heptadeca-1(16),2,4,6,13(17),14-hexaen-16-ol

C19H21NO3 (311.1521)


   

(2e)-3-(4-hydroxyphenyl)-n-[2-(4-methoxyphenyl)ethyl]-n-methylprop-2-enamide

(2e)-3-(4-hydroxyphenyl)-n-[2-(4-methoxyphenyl)ethyl]-n-methylprop-2-enamide

C19H21NO3 (311.1521)


   

(9r)-3,15-dimethoxy-10-methyl-10-azatetracyclo[7.7.1.0²,⁷.0¹³,¹⁷]heptadeca-1(16),2(7),3,5,13(17),14-hexaen-16-ol

(9r)-3,15-dimethoxy-10-methyl-10-azatetracyclo[7.7.1.0²,⁷.0¹³,¹⁷]heptadeca-1(16),2(7),3,5,13(17),14-hexaen-16-ol

C19H21NO3 (311.1521)


   

(1s)-2-[(2-hydroxyethyl)amino]-4-methoxy-1,5-dimethyl-6-oxocyclohexa-2,4-dien-1-yl (2r)-2-methylbutanoate

(1s)-2-[(2-hydroxyethyl)amino]-4-methoxy-1,5-dimethyl-6-oxocyclohexa-2,4-dien-1-yl (2r)-2-methylbutanoate

C16H25NO5 (311.1733)


   

(5r,12bs)-10-methoxy-5-methyl-7,8,12b,13-tetrahydro-5h-6-azatetraphene-2,11-diol

(5r,12bs)-10-methoxy-5-methyl-7,8,12b,13-tetrahydro-5h-6-azatetraphene-2,11-diol

C19H21NO3 (311.1521)


   

3-(4-hydroxyphenyl)-n-[2-(4-methoxyphenyl)ethyl]-n-methylprop-2-enamide

3-(4-hydroxyphenyl)-n-[2-(4-methoxyphenyl)ethyl]-n-methylprop-2-enamide

C19H21NO3 (311.1521)


   

(9r)-4,15-dimethoxy-10-methyl-10-azatetracyclo[7.7.1.0²,⁷.0¹³,¹⁷]heptadeca-1(16),2(7),3,5,13(17),14-hexaen-3-ol

(9r)-4,15-dimethoxy-10-methyl-10-azatetracyclo[7.7.1.0²,⁷.0¹³,¹⁷]heptadeca-1(16),2(7),3,5,13(17),14-hexaen-3-ol

C19H21NO3 (311.1521)


   

10',11'-dimethoxy-5'-methyl-5'-azaspiro[cyclohexane-1,2'-tricyclo[6.3.1.0⁴,¹²]dodecane]-1'(11'),2,5,8'(12'),9'-pentaen-4-one

10',11'-dimethoxy-5'-methyl-5'-azaspiro[cyclohexane-1,2'-tricyclo[6.3.1.0⁴,¹²]dodecane]-1'(11'),2,5,8'(12'),9'-pentaen-4-one

C19H21NO3 (311.1521)


   

(6r)-6-hydroxy-5-[(2-hydroxyethyl)amino]-3-methoxy-2,6-dimethyl-4-[(2r)-2-methylbutanoyl]cyclohexa-2,4-dien-1-one

(6r)-6-hydroxy-5-[(2-hydroxyethyl)amino]-3-methoxy-2,6-dimethyl-4-[(2r)-2-methylbutanoyl]cyclohexa-2,4-dien-1-one

C16H25NO5 (311.1733)


   

(9r)-14,15-dimethoxy-10-methyl-10-azatetracyclo[7.7.1.0²,⁷.0¹³,¹⁷]heptadeca-1(17),2,4,6,13,15-hexaen-16-ol

(9r)-14,15-dimethoxy-10-methyl-10-azatetracyclo[7.7.1.0²,⁷.0¹³,¹⁷]heptadeca-1(17),2,4,6,13,15-hexaen-16-ol

C19H21NO3 (311.1521)


   

(1s,5r,8r,9s,11r,14s,16r,17r,18r)-16-hydroxy-5-methyl-12-methylidene-7-azaheptacyclo[9.6.2.0¹,⁸.0⁵,¹⁷.0⁷,¹⁶.0⁹,¹⁴.0¹⁴,¹⁸]nonadecan-19-one

(1s,5r,8r,9s,11r,14s,16r,17r,18r)-16-hydroxy-5-methyl-12-methylidene-7-azaheptacyclo[9.6.2.0¹,⁸.0⁵,¹⁷.0⁷,¹⁶.0⁹,¹⁴.0¹⁴,¹⁸]nonadecan-19-one

C20H25NO2 (311.1885)


   

20-methoxy-5,7-dioxa-14-azapentacyclo[12.7.0.0¹,¹⁷.0²,¹⁰.0⁴,⁸]henicosa-2,4(8),9,16,18-pentaene

20-methoxy-5,7-dioxa-14-azapentacyclo[12.7.0.0¹,¹⁷.0²,¹⁰.0⁴,⁸]henicosa-2,4(8),9,16,18-pentaene

C19H21NO3 (311.1521)


   

14,15,16-trimethoxy-10-azatetracyclo[7.7.1.0²,⁷.0¹³,¹⁷]heptadeca-1(17),2,4,6,13,15-hexaene

14,15,16-trimethoxy-10-azatetracyclo[7.7.1.0²,⁷.0¹³,¹⁷]heptadeca-1(17),2,4,6,13,15-hexaene

C19H21NO3 (311.1521)


   

(2r)-2-[(3z)-hex-3-en-1-yl]-8-methoxy-1h,2h,3h,4h-pyrido[1,2-a]quinolin-6-one

(2r)-2-[(3z)-hex-3-en-1-yl]-8-methoxy-1h,2h,3h,4h-pyrido[1,2-a]quinolin-6-one

C20H25NO2 (311.1885)


   

(9s)-14,16-dimethoxy-10-methyl-10-azatetracyclo[7.7.1.0²,⁷.0¹³,¹⁷]heptadeca-1(16),2,4,6,13(17),14-hexaen-15-ol

(9s)-14,16-dimethoxy-10-methyl-10-azatetracyclo[7.7.1.0²,⁷.0¹³,¹⁷]heptadeca-1(16),2,4,6,13(17),14-hexaen-15-ol

C19H21NO3 (311.1521)


   

(1r,4s,5s,6s,10r,16r)-5-hydroxy-4,5,6-trimethyl-2,8-dioxa-13-azatricyclo[8.5.1.0¹³,¹⁶]hexadecane-3,7-dione

(1r,4s,5s,6s,10r,16r)-5-hydroxy-4,5,6-trimethyl-2,8-dioxa-13-azatricyclo[8.5.1.0¹³,¹⁶]hexadecane-3,7-dione

C16H25NO5 (311.1733)


   

2-(hex-3-en-1-yl)-8-methoxy-1h,2h,3h,4h-pyrido[1,2-a]quinolin-6-one

2-(hex-3-en-1-yl)-8-methoxy-1h,2h,3h,4h-pyrido[1,2-a]quinolin-6-one

C20H25NO2 (311.1885)


   

(12br)-10,11-dimethoxy-7,8,12b,13-tetrahydro-5h-6-azatetraphen-4-ol

(12br)-10,11-dimethoxy-7,8,12b,13-tetrahydro-5h-6-azatetraphen-4-ol

C19H21NO3 (311.1521)


   

10,11-dimethoxy-7,8,12b,13-tetrahydro-5h-6-azatetraphen-4-ol

10,11-dimethoxy-7,8,12b,13-tetrahydro-5h-6-azatetraphen-4-ol

C19H21NO3 (311.1521)


   

6-hydroxy-5-[(2-hydroxyethyl)amino]-3-methoxy-2,6-dimethyl-4-(2-methylbutanoyl)cyclohexa-2,4-dien-1-one

6-hydroxy-5-[(2-hydroxyethyl)amino]-3-methoxy-2,6-dimethyl-4-(2-methylbutanoyl)cyclohexa-2,4-dien-1-one

C16H25NO5 (311.1733)


   

6-hydroxy-8-methyl-7-(propanoyloxy)-8-azabicyclo[3.2.1]octan-3-yl (2e)-2-methylbut-2-enoate

6-hydroxy-8-methyl-7-(propanoyloxy)-8-azabicyclo[3.2.1]octan-3-yl (2e)-2-methylbut-2-enoate

C16H25NO5 (311.1733)


   

(9s)-14,15,16-trimethoxy-10-azatetracyclo[7.7.1.0²,⁷.0¹³,¹⁷]heptadeca-1(17),2,4,6,13,15-hexaene

(9s)-14,15,16-trimethoxy-10-azatetracyclo[7.7.1.0²,⁷.0¹³,¹⁷]heptadeca-1(17),2,4,6,13,15-hexaene

C19H21NO3 (311.1521)


   

(1r,2s,5s,6s,9r,12s,13r)-6,13-dimethyl-7-azapentacyclo[10.8.0.0²,⁹.0⁵,⁹.0¹³,¹⁸]icosa-14,17-dien-16-one

(1r,2s,5s,6s,9r,12s,13r)-6,13-dimethyl-7-azapentacyclo[10.8.0.0²,⁹.0⁵,⁹.0¹³,¹⁸]icosa-14,17-dien-16-one

C21H29NO (311.2249)


   

2-(1-hydroxy-3,7-dimethylocta-2,6-dien-1-yl)-1-methylquinolin-4-one

2-(1-hydroxy-3,7-dimethylocta-2,6-dien-1-yl)-1-methylquinolin-4-one

C20H25NO2 (311.1885)


   

2-[3-(2-hexylcyclopropyl)propyl]-1h-quinolin-4-one

2-[3-(2-hexylcyclopropyl)propyl]-1h-quinolin-4-one

C21H29NO (311.2249)


   

1-ethyl 3-(7-hydroxy-hexahydro-1h-pyrrolizin-1-yl)methyl 2-(propan-2-ylidene)propanedioate

1-ethyl 3-(7-hydroxy-hexahydro-1h-pyrrolizin-1-yl)methyl 2-(propan-2-ylidene)propanedioate

C16H25NO5 (311.1733)


   

14,16-dimethoxy-10-methyl-10-azatetracyclo[7.7.1.0²,⁷.0¹³,¹⁷]heptadeca-1(16),2,4,6,13(17),14-hexaen-15-ol

14,16-dimethoxy-10-methyl-10-azatetracyclo[7.7.1.0²,⁷.0¹³,¹⁷]heptadeca-1(16),2,4,6,13(17),14-hexaen-15-ol

C19H21NO3 (311.1521)


   

1-isocyano-1,6-dimethyl-4-[6-(prop-1-en-2-yl)-5,6-dihydro-2h-pyran-3-yl]-3,4,4a,7,8,8a-hexahydro-2h-naphthalene

1-isocyano-1,6-dimethyl-4-[6-(prop-1-en-2-yl)-5,6-dihydro-2h-pyran-3-yl]-3,4,4a,7,8,8a-hexahydro-2h-naphthalene

C21H29NO (311.2249)


   

(1r,2s,5s,6s,9r,11s)-2-isopropyl-5-isothiocyanato-5,9-dimethyl-10,12-dioxatricyclo[7.2.1.0¹,⁶]dodecan-11-ol

(1r,2s,5s,6s,9r,11s)-2-isopropyl-5-isothiocyanato-5,9-dimethyl-10,12-dioxatricyclo[7.2.1.0¹,⁶]dodecan-11-ol

C16H25NO3S (311.1555)


   

(9r)-4,15-dimethoxy-10-methyl-10-azatetracyclo[7.7.1.0²,⁷.0¹³,¹⁷]heptadeca-1(16),2,4,6,13(17),14-hexaen-16-ol

(9r)-4,15-dimethoxy-10-methyl-10-azatetracyclo[7.7.1.0²,⁷.0¹³,¹⁷]heptadeca-1(16),2,4,6,13(17),14-hexaen-16-ol

C19H21NO3 (311.1521)


   

5-[(4-methoxyphenyl)methyl]-6-methyl-2h,5h,7h,8h-[1,3]dioxolo[4,5-g]isoquinoline

5-[(4-methoxyphenyl)methyl]-6-methyl-2h,5h,7h,8h-[1,3]dioxolo[4,5-g]isoquinoline

C19H21NO3 (311.1521)


   

(2e)-n-[(2s)-2-methoxy-2-(4-methoxyphenyl)ethyl]-3-phenylprop-2-enimidic acid

(2e)-n-[(2s)-2-methoxy-2-(4-methoxyphenyl)ethyl]-3-phenylprop-2-enimidic acid

C19H21NO3 (311.1521)


   

(2s)-2-[(3z)-hex-3-en-1-yl]-8-methoxy-1h,2h,3h,4h-pyrido[1,2-a]quinolin-6-one

(2s)-2-[(3z)-hex-3-en-1-yl]-8-methoxy-1h,2h,3h,4h-pyrido[1,2-a]quinolin-6-one

C20H25NO2 (311.1885)


   

(9s)-4,16-dimethoxy-10-methyl-10-azatetracyclo[7.7.1.0²,⁷.0¹³,¹⁷]heptadeca-1(16),2,4,6,13(17),14-hexaen-3-ol

(9s)-4,16-dimethoxy-10-methyl-10-azatetracyclo[7.7.1.0²,⁷.0¹³,¹⁷]heptadeca-1(16),2,4,6,13(17),14-hexaen-3-ol

C19H21NO3 (311.1521)


   

(7-hydroxy-hexahydro-1h-pyrrolizin-1-yl)methyl 3-methyl-2-(propanoyloxy)but-2-enoate

(7-hydroxy-hexahydro-1h-pyrrolizin-1-yl)methyl 3-methyl-2-(propanoyloxy)but-2-enoate

C16H25NO5 (311.1733)


   

2-(but-2-en-2-yl)-3-(hydroxymethyl)-3-methyl-7-phenyl-2h-furo[3,2-c]pyridin-4-ol

2-(but-2-en-2-yl)-3-(hydroxymethyl)-3-methyl-7-phenyl-2h-furo[3,2-c]pyridin-4-ol

C19H21NO3 (311.1521)


   

(1s,2s,5s,6s,8r,9r,11r)-2-isopropyl-5-isothiocyanato-5,9-dimethyl-10-oxatricyclo[6.2.1.0¹,⁶]undecane-9,11-diol

(1s,2s,5s,6s,8r,9r,11r)-2-isopropyl-5-isothiocyanato-5,9-dimethyl-10-oxatricyclo[6.2.1.0¹,⁶]undecane-9,11-diol

C16H25NO3S (311.1555)


   

(9r)-14,15,16-trimethoxy-10-azatetracyclo[7.7.1.0²,⁷.0¹³,¹⁷]heptadeca-1(17),2,4,6,13,15-hexaene

(9r)-14,15,16-trimethoxy-10-azatetracyclo[7.7.1.0²,⁷.0¹³,¹⁷]heptadeca-1(17),2,4,6,13,15-hexaene

C19H21NO3 (311.1521)


   

(4r,7r)-n-[(1s)-1-hydroxyethyl]-6-methyl-6,11-diazatetracyclo[7.6.1.0²,⁷.0¹²,¹⁶]hexadeca-1(16),2,9,12,14-pentaene-4-carboximidic acid

(4r,7r)-n-[(1s)-1-hydroxyethyl]-6-methyl-6,11-diazatetracyclo[7.6.1.0²,⁷.0¹²,¹⁶]hexadeca-1(16),2,9,12,14-pentaene-4-carboximidic acid

C18H21N3O2 (311.1634)


   

(1s,4s,4as,8as)-1,6-dimethyl-4-[(6s)-6-(prop-1-en-2-yl)-5,6-dihydro-2h-pyran-3-yl]-3,4,4a,7,8,8a-hexahydro-2h-naphthalene-1-carbonitrile

(1s,4s,4as,8as)-1,6-dimethyl-4-[(6s)-6-(prop-1-en-2-yl)-5,6-dihydro-2h-pyran-3-yl]-3,4,4a,7,8,8a-hexahydro-2h-naphthalene-1-carbonitrile

C21H29NO (311.2249)


   

(6r,9s)-4,9-dimethyl-6-[(2s)-6-methylhept-5-en-2-yl]-6h,7h,8h,9h-naphtho[2,1-d][1,3]oxazole

(6r,9s)-4,9-dimethyl-6-[(2s)-6-methylhept-5-en-2-yl]-6h,7h,8h,9h-naphtho[2,1-d][1,3]oxazole

C21H29NO (311.2249)


   

(6s)-6-hydroxy-5-[(2-hydroxyethyl)amino]-3-methoxy-2,6-dimethyl-4-[(2s)-2-methylbutanoyl]cyclohexa-2,4-dien-1-one

(6s)-6-hydroxy-5-[(2-hydroxyethyl)amino]-3-methoxy-2,6-dimethyl-4-[(2s)-2-methylbutanoyl]cyclohexa-2,4-dien-1-one

C16H25NO5 (311.1733)


   

1-[(1r,2r,3as,4s,7s,7as)-1,7a-dihydroxy-7-isopropyl-4-isothiocyanato-4-methyl-hexahydro-1h-inden-2-yl]ethanone

1-[(1r,2r,3as,4s,7s,7as)-1,7a-dihydroxy-7-isopropyl-4-isothiocyanato-4-methyl-hexahydro-1h-inden-2-yl]ethanone

C16H25NO3S (311.1555)


   
   

1,6-dimethyl-4-[6-(prop-1-en-2-yl)-5,6-dihydro-2h-pyran-3-yl]-3,4,4a,7,8,8a-hexahydro-2h-naphthalene-1-carbonitrile

1,6-dimethyl-4-[6-(prop-1-en-2-yl)-5,6-dihydro-2h-pyran-3-yl]-3,4,4a,7,8,8a-hexahydro-2h-naphthalene-1-carbonitrile

C21H29NO (311.2249)


   

(8s,10s)-8-(2-hydroperoxypropan-2-yl)-5h,7h,8h,9h,10h-cyclohexa[b]carbazol-10-ol

(8s,10s)-8-(2-hydroperoxypropan-2-yl)-5h,7h,8h,9h,10h-cyclohexa[b]carbazol-10-ol

C19H21NO3 (311.1521)


   

10-methoxy-5-methyl-7,8,12b,13-tetrahydro-5h-6-azatetraphene-4,11-diol

10-methoxy-5-methyl-7,8,12b,13-tetrahydro-5h-6-azatetraphene-4,11-diol

C19H21NO3 (311.1521)


   

5-hydroxy-4,5,6-trimethyl-2,8-dioxa-13-azatricyclo[8.5.1.0¹³,¹⁶]hexadecane-3,7-dione

5-hydroxy-4,5,6-trimethyl-2,8-dioxa-13-azatricyclo[8.5.1.0¹³,¹⁶]hexadecane-3,7-dione

C16H25NO5 (311.1733)


   

(9r)-15,16-dimethoxy-10-methyl-10-azatetracyclo[7.7.1.0²,⁷.0¹³,¹⁷]heptadeca-1(16),2,4,6,13(17),14-hexaen-14-ol

(9r)-15,16-dimethoxy-10-methyl-10-azatetracyclo[7.7.1.0²,⁷.0¹³,¹⁷]heptadeca-1(16),2,4,6,13(17),14-hexaen-14-ol

C19H21NO3 (311.1521)


   

6,13-dimethyl-7-azapentacyclo[10.8.0.0²,⁹.0⁵,⁹.0¹³,¹⁸]icosa-17,19-dien-16-one

6,13-dimethyl-7-azapentacyclo[10.8.0.0²,⁹.0⁵,⁹.0¹³,¹⁸]icosa-17,19-dien-16-one

C21H29NO (311.2249)


   

2-(3-hydroxy-3,7-dimethylocta-1,6-dien-1-yl)-1-methylquinolin-4-one

2-(3-hydroxy-3,7-dimethylocta-1,6-dien-1-yl)-1-methylquinolin-4-one

C20H25NO2 (311.1885)


   

14,15-dimethoxy-10-methyl-10-azatetracyclo[7.7.1.0²,⁷.0¹³,¹⁷]heptadeca-1(17),2,4,6,13,15-hexaen-16-ol

14,15-dimethoxy-10-methyl-10-azatetracyclo[7.7.1.0²,⁷.0¹³,¹⁷]heptadeca-1(17),2,4,6,13,15-hexaen-16-ol

C19H21NO3 (311.1521)


   

(3s)-3-{[2-(2-methylbut-3-en-2-yl)-1h-indol-3-yl]methyl}-3,6-dihydropyrazine-2,5-diol

(3s)-3-{[2-(2-methylbut-3-en-2-yl)-1h-indol-3-yl]methyl}-3,6-dihydropyrazine-2,5-diol

C18H21N3O2 (311.1634)


   

n-[2-methoxy-2-(4-methoxyphenyl)ethyl]-3-phenylprop-2-enimidic acid

n-[2-methoxy-2-(4-methoxyphenyl)ethyl]-3-phenylprop-2-enimidic acid

C19H21NO3 (311.1521)


   

(5s)-5-[(4-methoxyphenyl)methyl]-6-methyl-2h,5h,7h,8h-[1,3]dioxolo[4,5-g]isoquinoline

(5s)-5-[(4-methoxyphenyl)methyl]-6-methyl-2h,5h,7h,8h-[1,3]dioxolo[4,5-g]isoquinoline

C19H21NO3 (311.1521)


   

(9s)-4,15-dimethoxy-10-methyl-10-azatetracyclo[7.7.1.0²,⁷.0¹³,¹⁷]heptadeca-1(16),2,4,6,13(17),14-hexaen-16-ol

(9s)-4,15-dimethoxy-10-methyl-10-azatetracyclo[7.7.1.0²,⁷.0¹³,¹⁷]heptadeca-1(16),2,4,6,13(17),14-hexaen-16-ol

C19H21NO3 (311.1521)


   

(9s)-5,15-dimethoxy-10-methyl-10-azatetracyclo[7.7.1.0²,⁷.0¹³,¹⁷]heptadeca-1(16),2,4,6,13(17),14-hexaen-16-ol

(9s)-5,15-dimethoxy-10-methyl-10-azatetracyclo[7.7.1.0²,⁷.0¹³,¹⁷]heptadeca-1(16),2,4,6,13(17),14-hexaen-16-ol

C19H21NO3 (311.1521)


   

2,11-dimethoxy-7,8,12b,13-tetrahydro-5h-6-azatetraphen-4-ol

2,11-dimethoxy-7,8,12b,13-tetrahydro-5h-6-azatetraphen-4-ol

C19H21NO3 (311.1521)


   

(1r,2s,5s,6s,9r,12s,13r)-6,13-dimethyl-7-azapentacyclo[10.8.0.0²,⁹.0⁵,⁹.0¹³,¹⁸]icosa-7,17-dien-16-one

(1r,2s,5s,6s,9r,12s,13r)-6,13-dimethyl-7-azapentacyclo[10.8.0.0²,⁹.0⁵,⁹.0¹³,¹⁸]icosa-7,17-dien-16-one

C21H29NO (311.2249)


   

(9s)-15,16-dimethoxy-10-methyl-10-azatetracyclo[7.7.1.0²,⁷.0¹³,¹⁷]heptadeca-1(16),2,4,6,13(17),14-hexaen-4-ol

(9s)-15,16-dimethoxy-10-methyl-10-azatetracyclo[7.7.1.0²,⁷.0¹³,¹⁷]heptadeca-1(16),2,4,6,13(17),14-hexaen-4-ol

C19H21NO3 (311.1521)


   

11,11,15-trimethyl-10,19-dioxa-2-azapentacyclo[14.2.1.0³,⁸.0⁹,¹⁸.0¹²,¹⁷]nonadeca-1,3,5,7,9(18)-pentaen-15-ol

11,11,15-trimethyl-10,19-dioxa-2-azapentacyclo[14.2.1.0³,⁸.0⁹,¹⁸.0¹²,¹⁷]nonadeca-1,3,5,7,9(18)-pentaen-15-ol

C19H21NO3 (311.1521)


   

2-isopropyl-5-isothiocyanato-5,9-dimethyl-10-oxatricyclo[6.2.1.0¹,⁶]undecane-9,11-diol

2-isopropyl-5-isothiocyanato-5,9-dimethyl-10-oxatricyclo[6.2.1.0¹,⁶]undecane-9,11-diol

C16H25NO3S (311.1555)


   

8-hydroperoxy-8-isopropyl-5-isothiocyanato-2,5-dimethyl-4,4a,6,7-tetrahydro-3h-naphthalen-2-ol

8-hydroperoxy-8-isopropyl-5-isothiocyanato-2,5-dimethyl-4,4a,6,7-tetrahydro-3h-naphthalen-2-ol

C16H25NO3S (311.1555)


   

1-(1,7a-dihydroxy-7-isopropyl-4-isothiocyanato-4-methyl-hexahydro-1h-inden-2-yl)ethanone

1-(1,7a-dihydroxy-7-isopropyl-4-isothiocyanato-4-methyl-hexahydro-1h-inden-2-yl)ethanone

C16H25NO3S (311.1555)


   

5-ethyl-4,5-dihydroxy-1-methyl-3-(2-methylnonanoyl)pyrrol-2-one

5-ethyl-4,5-dihydroxy-1-methyl-3-(2-methylnonanoyl)pyrrol-2-one

C17H29NO4 (311.2096)


   

n-{2-[4-(3-oxobutoxy)phenyl]ethyl}benzenecarboximidic acid

n-{2-[4-(3-oxobutoxy)phenyl]ethyl}benzenecarboximidic acid

C19H21NO3 (311.1521)


   

2-(but-2-en-2-yl)-3-(hydroxymethyl)-3-methyl-5-phenyl-2h-furo[2,3-b]pyridin-4-ol

2-(but-2-en-2-yl)-3-(hydroxymethyl)-3-methyl-5-phenyl-2h-furo[2,3-b]pyridin-4-ol

C19H21NO3 (311.1521)


   

(2s,3s)-3-[(1s)-12-carboxy-1-hydroxydodecyl]-2-isocyano-2-methyloxirane

(2s,3s)-3-[(1s)-12-carboxy-1-hydroxydodecyl]-2-isocyano-2-methyloxirane

C17H29NO4 (311.2096)


   

2-isopropyl-5-isothiocyanato-5,9-dimethyl-10,12-dioxatricyclo[7.2.1.0¹,⁶]dodecan-11-ol

2-isopropyl-5-isothiocyanato-5,9-dimethyl-10,12-dioxatricyclo[7.2.1.0¹,⁶]dodecan-11-ol

C16H25NO3S (311.1555)


   

(8ar)-6,8a-diisopropyl-2,2,4-trimethyl-8h,9h-cyclopenta[g]quinolin-7-one

(8ar)-6,8a-diisopropyl-2,2,4-trimethyl-8h,9h-cyclopenta[g]quinolin-7-one

C21H29NO (311.2249)


   

(10r,19s)-10-hydroxy-19-methyl-1-azacycloicosa-3,5,7,11,13,15,17-heptaen-2-one

(10r,19s)-10-hydroxy-19-methyl-1-azacycloicosa-3,5,7,11,13,15,17-heptaen-2-one

C20H25NO2 (311.1885)


   

2-[(1e,3r)-3-hydroxy-3,7-dimethylocta-1,6-dien-1-yl]-1-methylquinolin-4-one

2-[(1e,3r)-3-hydroxy-3,7-dimethylocta-1,6-dien-1-yl]-1-methylquinolin-4-one

C20H25NO2 (311.1885)


   

(2r,3s)-2-[(2e)-but-2-en-2-yl]-3-(hydroxymethyl)-3-methyl-5-phenyl-2h-furo[2,3-b]pyridin-4-ol

(2r,3s)-2-[(2e)-but-2-en-2-yl]-3-(hydroxymethyl)-3-methyl-5-phenyl-2h-furo[2,3-b]pyridin-4-ol

C19H21NO3 (311.1521)


   

2-[(3z)-hex-3-en-1-yl]-8-methoxy-1h,2h,3h,4h-pyrido[1,2-a]quinolin-6-one

2-[(3z)-hex-3-en-1-yl]-8-methoxy-1h,2h,3h,4h-pyrido[1,2-a]quinolin-6-one

C20H25NO2 (311.1885)


   

(2r,3r)-2-[(2e)-but-2-en-2-yl]-3-(hydroxymethyl)-3-methyl-7-phenyl-2h-furo[3,2-c]pyridin-4-ol

(2r,3r)-2-[(2e)-but-2-en-2-yl]-3-(hydroxymethyl)-3-methyl-7-phenyl-2h-furo[3,2-c]pyridin-4-ol

C19H21NO3 (311.1521)


   

(1r,2s,5s,6s,9r,12s,13r)-6,13-dimethyl-7-azapentacyclo[10.8.0.0²,⁹.0⁵,⁹.0¹³,¹⁸]icosa-17,19-dien-16-one

(1r,2s,5s,6s,9r,12s,13r)-6,13-dimethyl-7-azapentacyclo[10.8.0.0²,⁹.0⁵,⁹.0¹³,¹⁸]icosa-17,19-dien-16-one

C21H29NO (311.2249)


   

3-[(2s)-butan-2-yl]-6-(1h-indol-3-ylmethyl)-5-methoxy-1h-pyrazin-2-one

3-[(2s)-butan-2-yl]-6-(1h-indol-3-ylmethyl)-5-methoxy-1h-pyrazin-2-one

C18H21N3O2 (311.1634)