Exact Mass: 203.1634

Exact Mass Matches: 203.1634

Found 302 metabolites which its exact mass value is equals to given mass value 203.1634, within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error 0.01 dalton.

Vernam

N,N-dipropyl(propylsulfanyl)formamide

C10H21NOS (203.1344)


   

Pebulate

N-butyl-N-ethyl(propylsulfanyl)formamide

C10H21NOS (203.1344)


   

N-(3-Methylbut-2-EN-1-YL)-9H-purin-6-amine

(3-Methyl-but-2-enyl)-(7(9)H-purin-6-yl)-amine

C10H13N5 (203.1171)


N6-prenyladenine, also known as isopentenyladenine or ip, is a member of the class of compounds known as 6-alkylaminopurines. 6-alkylaminopurines are compounds that contain an alkylamine group attached at the 6-position of a purine. Purine is a bicyclic aromatic compound made up of a pyrimidine ring fused to an imidazole ring. N6-prenyladenine is practically insoluble (in water) and a very weakly acidic compound (based on its pKa). N6-prenyladenine can be found in a number of food items such as lime, lemon thyme, nectarine, and napa cabbage, which makes n6-prenyladenine a potential biomarker for the consumption of these food products. D006133 - Growth Substances > D010937 - Plant Growth Regulators > D003583 - Cytokinins Acquisition and generation of the data is financially supported in part by CREST/JST. CONFIDENCE Reference Standard (Level 1); INTERNAL_ID 74 6-(γ,γ-Dimethylallylamino)purine is a plant growth substance. 6-(γ,γ-Dimethylallylamino)purine is a plant growth substance.

   

Triacanthine

3-(3-methylbut-2-en-1-yl)-3H-purin-6-amine

C10H13N5 (203.1171)


   

N-Methyl-N-phenylcyclohexanemethylamine

Benzenamine, N-(cyclohexylmethyl)-N-methyl-

C14H21N (203.1674)


   

9-methylthiononanaldoxime

9-methylthiononanaldoxime

C10H21NOS (203.1344)


   

Crotamiton

2-Butenamide, N-ethyl-N-(2-methylphenyl)-

C13H17NO (203.131)


Crotamiton is only found in individuals that have used or taken this drug. It is a scabicidal and antipruritic agent available as a cream or lotion for topical use only. It is a colorless to slightly yellowish oil, having a faint amine-like odor. It is miscible with alcohol and with methanol.Crotamiton is an antiparasitic that is toxic to the scabies mite. Crotamiton also relieves itching by producing what is called a counter-irritation. As crotamiton evaporates from the skin, it produces a cooling effect. This cooling effect helps to divert your bodys attention away from the itching. C254 - Anti-Infective Agent > C28394 - Topical Anti-Infective Agent D016573 - Agrochemicals D010575 - Pesticides

   

Acetyl-L-carnitine

(3R)-3-(acetyloxy)-4-(trimethylazaniumyl)butanoate

C9H17NO4 (203.1158)


L-Acetylcarnitine (Acetylcarnitine or ALC or LAC) is an acetic acid ester of carnitine that facilitates the movement of acetyl-CoA into the matrices of mammalian mitochondria during the oxidation of fatty acids. Acetylcarnitine is an endogenous compound widely distributed in many tissues, including brain. Chemically, acetylcarnitine is the acetylated derivative of the amino acid L-carnitine whose function is generally correlated with regulation of energy metabolism within mitochondria. The synthesis of acetylcarnitine is catalyzed by the enzyme carnitine acetyltransferase (CAT), which is located on the inner mitochondrial membrane as well as in endoplasmic reticulum and peroxisome. CAT promotes the transfer of an acetyl group from acetyl-Coenzyme A (acetyl-CoA) to carnitine, thereby producing acetylcarnitine and free CoA (PMID: 29267192). After being synthetized, acetylcarnitine is transported outside mitochondria into the cytosol by the enzyme carnitine/acetylcarnitine translocase (CACT). This is a crucial metabolic reaction for beta-oxidation of fatty acids whereby acetylcarnitine facilitates the transport of acetyl-CoA across mitochondrial membranes (PMID: 29267192). In addition to his metabolic role, L-acetylcarnitine possesses unique neuroprotective, neuromodulatory, and neurotrophic properties. acetylcarnitine is mobile throughout the plasma membranes and can rapidly cross blood-brain barrier. Indeed, acetylcarnitine can be transported by the high-affinity sodium-dependent organic cation/transporter (OCTN2), which is functionally expressed in cells forming the blood-brain barrier (PMID: 29267192). A wide range of mechanisms have been proposed to explain the multiplicity of acetylcarnitine activities within nervous tissues. In particular, it has been demonstrated that acetylcarnitine modulates the activity of nerve growth factor (NGF) and enhances the expression of NGF receptors in striatum/hippocampus during development (PMID: 29267192). Moreover, acetylcarnitine modulates different neurotransmitter systems, including the GABAergic, dopaminergic, and cholinergic system by increasing acetyl-CoA content and choline acetyltransferase (ChAT) activity. This may play an important role in counteracting various neurodegenerative disease processes (PMID: 15363640).

   

N-Lactoylleucine

(2S)-2-{[(2S)-1,2-dihydroxypropylidene]amino}-4-methylpentanoate

C9H17NO4 (203.1158)


N-Lactoylleucine is a lactoyl derivative of phenylalanine. N-Lactoyl-amino acids are ubiquitous pseudodipeptides of lactic acid and amino acids that are rapidly formed by reverse proteolysis. A protease, cytosolic nonspecific dipeptidase 2 (CNDP2), catalyzes their formation. The plasma levels of these metabolites strongly correlate with plasma levels of lactate and amino acid (PMID: 25964343).

   

Lysylglycine

2-[(2S)-2,6-diaminohexanamido]acetic acid

C8H17N3O3 (203.127)


Lysylglycine is a dipeptide composed of lysine and glycine. 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.

   

Glycyl-Lysine

6-Amino-2-[(2-amino-1-hydroxyethylidene)amino]hexanoate

C8H17N3O3 (203.127)


Glycyl-Lysine is a dipeptide composed of glycine and lysine. 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. This dipeptide has not yet been identified in human tissues or biofluids and so it is classified as an Expected metabolite.

   

1-Carboxyethylleucine

(2S)-2-{[(1R)-1-carboxyethyl]amino}-4-methylpentanoic acid

C9H17NO4 (203.1158)


1-Carboxyethylleucine belongs to the class of organic compounds known as leucine and derivatives. Leucine and derivatives are compounds containing leucine or a derivative thereof resulting from a reaction of leucine at the amino group or the carboxy group, or from the replacement of any hydrogen of glycine by a heteroatom. 1-Carboxyethylleucine was identified as one of forty plasma metabolites that could be used to predict gut microbiome Shannon diversity (PMID: 31477923). Shannon diversity is a metric that summarizes both species abundance and evenness, and it has been suggested as a marker for microbiome health.

   

Acetyl-D-carnitine

(3S)-3-(acetyloxy)-4-(trimethylazaniumyl)butanoate

C9H17NO4 (203.1158)


Acetyl-D-carnitine is an acylcarnitine. More specifically, it is an acetic 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. Acetyl-D-carnitine is therefore classified as a long chain AC. As a long-chain acylcarnitine Acetyl-D-carnitine is generally formed through esterification with long-chain fatty acids obtained from the diet. The main function of most long-chain acylcarnitines is to ensure long chain fatty acid transport into the mitochondria (PMID: 22804748). Altered levels of long-chain acylcarnitines can serve as useful markers for inherited disorders of long-chain fatty acid metabolism. In particular Acetyl-D-carnitine is elevated in the blood or plasma of individuals with very long chain acyl-CoA dehydrogenase deficiency (PMID: 9034211), colorectal cancer (PMID: 25105552), short-chain 3-hydroxyacyl-CoA dehydrogenase deficiency (PMID: 11489939), paclitaxel induced neuropathy (PMID: 29946863), type 2 diabetes Mellitus (PMID: 28726959; PMID: 25964024, PMID: 28726959, PMID: 19369366, PMID: 24358186), chronic heart failure (PMID: 22622056), ornithine transcarbamylase (PMID: 3346778), pre-diabetes (PMID: 23010998, PMID: 24358186), type 1 diabetes mellitus (PMID: 16789638), methylmalonic acidemia (PMID: 8214594), myeloma (PMID: 30096165), and diastolic heart failure (PMID: 26010610). It is also decreased in the blood or plasma of individuals with 3-methyl-crotonyl-glycinuria (PMID: 25732994), antiviral drug induced neuropathy (PMID: 9030365, PMID: 11364244), Alzheimer Disease (PMID: 27196316), major depressive disorder (PMID: 30061399), carnitine palmitoyltransferase 2 deficiency (PMID: 20543534), Familial Mediterranean Fever (PMID: 29900937), chronic fatigue syndrome (PMID: 9854142), methylmalonic acidemia (PMID: 15164354), hepatocellular carcinoma (PMID: 26976432, PMID: 31662827), and coronary artery disease (PMID: 20173117). Acetyl-D-carnitine is elevated in the urine of individuals with colorectal cancer (25105552), uterine fibroids (32590215), heart failure (8070147), diabetes mellitus (10221661), and hepatocellular carcinoma (24923488). It is also decreased in the urine of individuals with carnitine palmitoyltransferase 2 deficiency (20543534). Carnitine palmitoyltransferase I (CPT I, EC:2.3.1.21) is involved in the synthesis of long-chain acylcarnitines (more than C12) on the mitochondrial outer membrane. Elevated serum/plasma levels of long-chain acylcarnitines are not only markers for incomplete FA oxidation but also are indicators of altered carbohydrate and lipid metabolism. High serum concentrations of long-chain acylcarnitines in the postprandial or fed state are markers of insulin resistance and arise from insulins inability to inhibit CPT-1-dependent fatty acid metabolism in muscles and the heart (PMID: 19073774). Increased intracellular content of long-chain acylcarnitines is thought to serve as a feedback inhibition mechanism of insulin action (PMID: 23258903). In healthy subjects, incre...

   

DL-Acetylcarnitine

3-(Acetyloxy)-4-(trimethylammonio)butanoic acid

C9H17NO4 (203.1158)


DL-Acetylcarnitine is an acylcarnitine. More specifically, it is an acetic 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. DL-Acetylcarnitine is therefore classified as a long chain AC. As a long-chain acylcarnitine DL-Acetylcarnitine is generally formed through esterification with long-chain fatty acids obtained from the diet. The main function of most long-chain acylcarnitines is to ensure long chain fatty acid transport into the mitochondria (PMID: 22804748). Altered levels of long-chain acylcarnitines can serve as useful markers for inherited disorders of long-chain fatty acid metabolism. In particular DL-Acetylcarnitine is elevated in the blood or plasma of individuals with very long chain acyl-CoA dehydrogenase deficiency (PMID: 9034211), colorectal cancer (PMID: 25105552), short-chain 3-hydroxyacyl-CoA dehydrogenase deficiency (PMID: 11489939), paclitaxel induced neuropathy (PMID: 29946863), type 2 diabetes Mellitus (PMID: 28726959; PMID: 25964024, PMID: 28726959, PMID: 19369366, PMID: 24358186), chronic heart failure (PMID: 22622056), ornithine transcarbamylase (PMID: 3346778), pre-diabetes (PMID: 23010998, PMID: 24358186), type 1 diabetes mellitus (PMID: 16789638), methylmalonic acidemia (PMID: 8214594), myeloma (PMID: 30096165), and diastolic heart failure (PMID: 26010610). It is also decreased in the blood or plasma of individuals with 3-methyl-crotonyl-glycinuria (PMID: 25732994), antiviral drug induced neuropathy (PMID: 9030365, PMID: 11364244), Alzheimer Disease (PMID: 27196316), major depressive disorder (PMID: 30061399), carnitine palmitoyltransferase 2 deficiency (PMID: 20543534), Familial Mediterranean Fever (PMID: 29900937), chronic fatigue syndrome (PMID: 9854142), methylmalonic acidemia (PMID: 15164354), hepatocellular carcinoma (PMID: 26976432, PMID: 31662827), and coronary artery disease (PMID: 20173117). DL-Acetylcarnitine is elevated in the urine of individuals with colorectal cancer (25105552), uterine fibroids (32590215), heart failure (8070147), diabetes mellitus (10221661), and hepatocellular carcinoma (24923488). It is also decreased in the urine of individuals with carnitine palmitoyltransferase 2 deficiency (20543534). Carnitine palmitoyltransferase I (CPT I, EC:2.3.1.21) is involved in the synthesis of long-chain acylcarnitines (more than C12) on the mitochondrial outer membrane. Elevated serum/plasma levels of long-chain acylcarnitines are not only markers for incomplete FA oxidation but also are indicators of altered carbohydrate and lipid metabolism. High serum concentrations of long-chain acylcarnitines in the postprandial or fed state are markers of insulin resistance and arise from insulins inability to inhibit CPT-1-dependent fatty acid metabolism in muscles and the heart (PMID: 19073774). Increased intracellular content of long-chain acylcarnitines is thought to serve as a feedback inhibition mechanism of insulin action (PMID: 23258903). In healthy subjects, incre... An acetic acid ester of carnitine that facilitates movement of acetyl CoA into the matrices of mammalian mitochondria during the oxidation of fatty acids. In addition to his metabolic role, acetyl-L-carnitine (ALC) posses unique neuroprotective, neuromodulatory, and neurotrophic properties this may play an important role in counteracting various disease processes. (PubMed ID 15363640) [HMDB] N - Nervous system > N06 - Psychoanaleptics > N06B - Psychostimulants, agents used for adhd and nootropics D002491 - Central Nervous System Agents > D018697 - Nootropic Agents D018977 - Micronutrients > D014815 - Vitamins

   

1-Carboxyethylisoleucine

(2S,3S)-2-[(1-carboxyethyl)amino]-3-methylpentanoic acid

C9H17NO4 (203.1158)


   

S-(2-(N,N-Diisopropylamino)ethyl)isothiourea

[2-(Carbamimidoylsulphanyl)ethyl]bis(propan-2-yl)amine

C9H21N3S (203.1456)


   

Eticyclidine

N-Ethyl-1-phenylcyclohexylamine hydrochloride

C14H21N (203.1674)


C78272 - Agent Affecting Nervous System > C245 - Anesthetic Agent

   

Glutamic acid diethyl ester

Glutamic acid diethyl ester hydrochloride, (D)-isomer

C9H17NO4 (203.1158)


   

1-(Benzofuran-5-yl)-N-ethylpropan-2-amine

[1-(1-benzofuran-5-yl)propan-2-yl](ethyl)amine

C13H17NO (203.131)


   

Lysyl-Glycine

2-[(2,6-diamino-1-hydroxyhexylidene)amino]acetic acid

C8H17N3O3 (203.127)


   

Hyacinthacine B3

1S,2R,3R,5R,7R,7aR)-3-Hydroxymethyl-5-methyl-1,2,7-trihydroxypyrrolizidine

C9H17NO4 (203.1158)


   

Paniculidine C

Paniculidine C

C13H17NO (203.131)


   

Hyacinthacine B1

(1S,2R,3R,5R,7aR)-1,2-Dihydroxy-3,5-dihydroxymethylpyrrolizidine

C9H17NO4 (203.1158)


   

(-)-Aphanorphine

(-)-8-Hydroxy-1,3-dimethyl-2,3,4,5-tetrahydro-1,4-methano-3-benzazepine

C13H17NO (203.131)


   

Hyacinthacine B2

(1S,2R,3R,5S,7aR)-1,2-Dihydroxy-3,5-dihydroxymethylpyrrolizidine

C9H17NO4 (203.1158)


   

4-Acetyl-4-phenylpiperidine

4-Acetyl-4-phenylpiperidine

C13H17NO (203.131)


   

1-(Benzofuran-5-yl)-N-ethylpropan-2-amine

1-(Benzofuran-5-yl)-N-ethylpropan-2-amine

C13H17NO (203.131)


   

Deschloroketamine

Deschloroketamine

C13H17NO (203.131)


   

1-{1-methyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl}pyrrolidine

1-{1-methyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl}pyrrolidine

C10H13N5 (203.1171)


   

UNII-LWB2M746C9

UNII-LWB2M746C9

C13H17NO (203.131)


   

Selegiline N-oxide

Selegiline N-oxide

C13H17NO (203.131)


   

alpha-Pyrrolidinopropiophenone

1-phenyl-2-pyrrolidin-1-ylpropan-1-one

C13H17NO (203.131)


   

Acetyl-carnitine

Acetyl-carnitine

C9H17NO4 (203.1158)


   

6-(gamma,gamma-Dimethylallylamino)purine

6-(gamma,gamma-Dimethylallylamino)purine

C10H13N5 (203.1171)


   

1,3,6,6-Tetramethyl-6,7-dihydroisoquinolin-8(5H)-one

1,3,6,6-Tetramethyl-6,7-dihydroisoquinolin-8(5H)-one

C13H17NO (203.131)


   

Di-Me ester-(??)-2-Aminoheptanedioic acid

Di-Me ester-(??)-2-Aminoheptanedioic acid

C9H17NO4 (203.1158)


   

SCHEMBL1864995

SCHEMBL1864995

C9H17NO4 (203.1158)


   

1,2-Dihydroxy-3,5-bis(hydroxymethyl)hexahydro-1H-pyrrolizine

1,2-Dihydroxy-3,5-bis(hydroxymethyl)hexahydro-1H-pyrrolizine

C9H17NO4 (203.1158)


   

UNII-299A0P8472

UNII-299A0P8472

C10H13N5 (203.1171)


   
   

diethyl 3-aminopentanedioate

diethyl 3-aminopentanedioate

C9H17NO4 (203.1158)


   
   

118964-06-0

118964-06-0

C13H17NO (203.131)


   

2,6-Nonamethylene pyridine

2,6-Nonamethylene pyridine

C14H21N (203.1674)


   

(2Z)-N-isobutyl-2-nonene-6,8-diynamide|(Z)-non-2-en-6,8-diynoic acid isobutylamide|2-Methylpropylamide-2-Phenylethylamide-(Z)-2-Nonene-6,8-diynoic acid

(2Z)-N-isobutyl-2-nonene-6,8-diynamide|(Z)-non-2-en-6,8-diynoic acid isobutylamide|2-Methylpropylamide-2-Phenylethylamide-(Z)-2-Nonene-6,8-diynoic acid

C13H17NO (203.131)


   

2-(3H-indol-3-ylmethyl)butan-1-ol

2-(3H-indol-3-ylmethyl)butan-1-ol

C13H17NO (203.131)


   

N6-(Delta2-isopentenyl) adenine

N6-(Delta2-isopentenyl) adenine

C10H13N5 (203.1171)


   

CHEMBL298115

CHEMBL298115

C10H13N5 (203.1171)


   

3-(3-methylbut-2-en-1-yl)-3H-purin-6-amine

3-(3-methylbut-2-en-1-yl)-3H-purin-6-amine

C10H13N5 (203.1171)


   

5-(pent-2-en-4-ynyl)-8-methylindolizidine

5-(pent-2-en-4-ynyl)-8-methylindolizidine

C14H21N (203.1674)


   

2-pentyl-1,2,3,4-tetrahydroquinoline

2-pentyl-1,2,3,4-tetrahydroquinoline

C14H21N (203.1674)


   

R-Deprenyl N-Oxide

R-Deprenyl N-Oxide

C13H17NO (203.131)


CONFIDENCE standard compound; EAWAG_UCHEM_ID 3461 CONFIDENCE standard compound; INTERNAL_ID 2117

   

Crotamiton

(E)-N-ethyl-N-(2-methylphenyl)but-2-enamide

C13H17NO (203.131)


C254 - Anti-Infective Agent > C28394 - Topical Anti-Infective Agent D016573 - Agrochemicals D010575 - Pesticides CONFIDENCE standard compound; INTERNAL_ID 650; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 8954; ORIGINAL_PRECURSOR_SCAN_NO 8953 CONFIDENCE standard compound; INTERNAL_ID 650; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 8989; ORIGINAL_PRECURSOR_SCAN_NO 8988 CONFIDENCE standard compound; INTERNAL_ID 650; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9012; ORIGINAL_PRECURSOR_SCAN_NO 9011 CONFIDENCE standard compound; INTERNAL_ID 650; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9032; ORIGINAL_PRECURSOR_SCAN_NO 9030 CONFIDENCE standard compound; INTERNAL_ID 650; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9049; ORIGINAL_PRECURSOR_SCAN_NO 9047 CONFIDENCE standard compound; INTERNAL_ID 650; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 9054; ORIGINAL_PRECURSOR_SCAN_NO 9053 CONFIDENCE standard compound; INTERNAL_ID 2699 CONFIDENCE standard compound; INTERNAL_ID 8580 CONFIDENCE standard compound; EAWAG_UCHEM_ID 3200

   

Isopentenyl-Adenine

Isopentenyl-Adenine

C10H13N5 (203.1171)


Acquisition and generation of the data is financially supported by the Max-Planck-Society

   

isopentenyl-Adenine-[d6]

isopentenyl-Adenine-[d6]

C10H13N5 (203.1171)


Acquisition and generation of the data is financially supported by the Max-Planck-Society

   

O-Acetyl-L-carnitine

O-Acetyl-L-carnitine

C9H17NO4 (203.1158)


An O-acyl-L-carnitine where the acyl group specified is acetyl. It facilitates movement of acetyl-CoA into the matrices of mammalian mitochondria during the oxidation of fatty acids.

   

N6-(delta2-Isopentenyl)-adenine

6-(γ,γ-Dimethylallylamino)purine

C10H13N5 (203.1171)


6-(γ,γ-Dimethylallylamino)purine is a plant growth substance. 6-(γ,γ-Dimethylallylamino)purine is a plant growth substance.

   

6-(γ,γ-Dimethylallylamino)purine

6-(gamma,gamma-Dimethylallylamino)purine

C10H13N5 (203.1171)


6-(γ,γ-Dimethylallylamino)purine is a plant growth substance. 6-(γ,γ-Dimethylallylamino)purine is a plant growth substance.

   

3-(3-methylbut-2-enyl)purin-6-amine

NCGC00179816-02!3-(3-methylbut-2-enyl)purin-6-amine

C10H13N5 (203.1171)


   

methyl 2-(2-hydroxypropanoylamino)-3-methylbutanoate

NCGC00380813-01!methyl 2-(2-hydroxypropanoylamino)-3-methylbutanoate

C9H17NO4 (203.1158)


   

DEP_204.1383_10.9

DEP_204.1383_10.9

C13H17NO (203.131)


CONFIDENCE Transformation product with Reference Standard (Level 1); INTERNAL_ID 501

   

Isopentenyladenine

Isopentenyladenine

C10H13N5 (203.1171)


   

Acetyl-D-carnitine

Acetyl-D-carnitine

C9H17NO4 (203.1158)


CONFIDENCE standard compound; INTERNAL_ID 252

   

Acetylcarnitine

Acetyllcarnitine

C9H17NO4 (203.1158)


N - Nervous system > N06 - Psychoanaleptics > N06B - Psychostimulants, agents used for adhd and nootropics D002491 - Central Nervous System Agents > D018697 - Nootropic Agents D018977 - Micronutrients > D014815 - Vitamins MS2 deconvoluted using MS2Dec from all ion fragmentation data, MetaboLights identifier MTBLS1040; RDHQFKQIGNGIED_STSL_0139_Acetylcarnitine_0031fmol_180430_S2_LC02_MS02_47; Spectrum acquired as described in Naz et al 2017 PMID 28641411. Preparation and submission to MassBank of North America by Chaleckis R. and Tada I. MS2 deconvoluted using CorrDec from all ion fragmentation data, MetaboLights identifier MTBLS1040; Spectrum acquired as described in Naz et al 2017 PMID 28641411. Preparation and submission to MassBank of North America by Chaleckis R. and Tada I.

   

L-Acetylcarnitine

O-Acetyl-L-carnitine

C9H17NO4 (203.1158)


   

Glutamic acid diethyl ester

Glutamic acid diethyl ester

C9H17NO4 (203.1158)


   

O-Acetylcarnitine

O-Acetylcarnitine

C9H17NO4 (203.1158)


An O-acylcarnitine having acetyl as the acyl substituent.

   
   
   

Succinylmonocholine

Succinylmonocholine

C9H17NO4 (203.1158)


   

(5S,8R)-8-methyl-5-((E)-pent-2-en-4-yn-1-yl)octahydroindolizine

(5S,8R)-8-methyl-5-((E)-pent-2-en-4-yn-1-yl)octahydroindolizine

C14H21N (203.1674)


   

L-Glutamic acid n-butyl ester

L-Glutamic acid n-butyl ester

C9H17NO4 (203.1158)


   

Gly-lys

2-(2,6-diaminohexanamido)acetic acid

C8H17N3O3 (203.127)


A dipeptide formed from glycine and L-lysine residues.

   

Lys-gly

6-amino-2-(2-aminoacetamido)hexanoic acid

C8H17N3O3 (203.127)


A dipeptide formed from L-lysine and glycine residues.

   

Lauric acid(d3)

Dodecanoic acid(d3)

C12H21D3O2 (203.1965)


   

CAR 2:0

(3R)-3-acetyloxy-4-(trimethylazaniumyl)butanoate

C9H17NO4 (203.1158)


N - Nervous system > N06 - Psychoanaleptics > N06B - Psychostimulants, agents used for adhd and nootropics D002491 - Central Nervous System Agents > D018697 - Nootropic Agents D018977 - Micronutrients > D014815 - Vitamins COVID info from COVID-19 Disease Map, clinicaltrial, clinicaltrials, clinical trial, clinical trials Corona-virus Coronavirus SARS-CoV-2 COVID-19 SARS-CoV COVID19 SARS2 SARS

   

9H-Purin-6-amine, N-cyclopentyl-

9H-Purin-6-amine, N-cyclopentyl-

C10H13N5 (203.1171)


   

5-methoxy-2,3-dihydrospiro[indene-1,2-pyrrolidine]

5-methoxy-2,3-dihydrospiro[indene-1,2-pyrrolidine]

C13H17NO (203.131)


   

N-BOC-D/L-NORVALINOL

N-BOC-D/L-NORVALINOL

C10H21NO3 (203.1521)


   

(4-methylphenyl)-piperidin-4-ylmethanone

(4-methylphenyl)-piperidin-4-ylmethanone

C13H17NO (203.131)


   

1,1-Di-tert-butoxy-N,N-dimethylmethanamine

1,1-Di-tert-butoxy-N,N-dimethylmethanamine

C11H25NO2 (203.1885)


   

1,1-Dibutoxy-N,N-dimethylmethanamine

1,1-Dibutoxy-N,N-dimethylmethanamine

C11H25NO2 (203.1885)


   

1H-Pyrazolo[4,3-d]pyrimidin-7-amine,N-cyclobutyl-3-methyl-(9CI)

1H-Pyrazolo[4,3-d]pyrimidin-7-amine,N-cyclobutyl-3-methyl-(9CI)

C10H13N5 (203.1171)


   

2,2-bis(trimethylsilyl)acetamide

2,2-bis(trimethylsilyl)acetamide

C8H21NOSi2 (203.1162)


   

tert-butyl N-(2-hydroxyethyl)-N-propylcarbamate

tert-butyl N-(2-hydroxyethyl)-N-propylcarbamate

C10H21NO3 (203.1521)


   

4-(2-Ethyl-1-methyl-1H-imidazol-5-yl)-2-pyrimidinamine

4-(2-Ethyl-1-methyl-1H-imidazol-5-yl)-2-pyrimidinamine

C10H13N5 (203.1171)


   

N-BOC-D/L-VALINOL

N-BOC-D/L-VALINOL

C10H21NO3 (203.1521)


   

1-(4-FLUOROBENZYL)PIPERIDIN-4-AMINE

1-(4-FLUOROBENZYL)PIPERIDIN-4-AMINE

C12H17N3 (203.1422)


   

1-Benzyl-azepan-3-one

1-Benzyl-azepan-3-one

C13H17NO (203.131)


   

4-(1-PIPERAZINYL)-1H-PYRROLO[2,3-D]PYRIMIDINE

4-(1-PIPERAZINYL)-1H-PYRROLO[2,3-D]PYRIMIDINE

C10H13N5 (203.1171)


   

3-Methyl-3H-spiro[isobenzofuran-1,4-piperidine] hydrochloride

3-Methyl-3H-spiro[isobenzofuran-1,4-piperidine] hydrochloride

C13H17NO (203.131)


   

(2-CYANOPHENYL)ACETONE

(2-CYANOPHENYL)ACETONE

C9H21N3S (203.1456)


   

1-Cyclohexyl-2-pyridin-2-yl-ethanone

1-Cyclohexyl-2-pyridin-2-yl-ethanone

C13H17NO (203.131)


   

Ac-L-Ser(tBu)-OH

Ac-L-Ser(tBu)-OH

C9H17NO4 (203.1158)


   

5,6-Dihydro-2-phenyl-4,4,6-trimethyl-1,3(4H)-oxazine

5,6-Dihydro-2-phenyl-4,4,6-trimethyl-1,3(4H)-oxazine

C13H17NO (203.131)


   

2-Methyl-2-propanyl (2S)-2-(fluoromethyl)-1-pyrrolidinecarboxylat e

2-Methyl-2-propanyl (2S)-2-(fluoromethyl)-1-pyrrolidinecarboxylat e

C10H18FNO2 (203.1322)


   

1-(4,6-DIMETHYLPYRIMIDIN-2-YL)-3-METHYL-1H-PYRAZOL-5-AMINE

1-(4,6-DIMETHYLPYRIMIDIN-2-YL)-3-METHYL-1H-PYRAZOL-5-AMINE

C10H13N5 (203.1171)


   

1-Benzyl-4-methyl-3-piperidinone

1-Benzyl-4-methyl-3-piperidinone

C13H17NO (203.131)


   

Boc-D-Me-Ala-OH

Boc-D-Me-Ala-OH

C9H17NO4 (203.1158)


   

(1-BENZYL-1,2,3,6-TETRAHYDROPYRIDIN-4-YL)METHANOL

(1-BENZYL-1,2,3,6-TETRAHYDROPYRIDIN-4-YL)METHANOL

C13H17NO (203.131)


   

4-hexoxybenzonitrile

4-hexoxybenzonitrile

C13H17NO (203.131)


   

3-(2-methoxy-ethylamino)-propionic acid tert-butyl ester

3-(2-methoxy-ethylamino)-propionic acid tert-butyl ester

C10H21NO3 (203.1521)


   

Boc-N-ethylglycine

Boc-N-ethylglycine

C9H17NO4 (203.1158)


   

N-Boc-L-valinol

N-Boc-L-valinol

C10H21NO3 (203.1521)


   

2-(tert-butoxycarbonylamino)butanoic acid

2-(tert-butoxycarbonylamino)butanoic acid

C9H17NO4 (203.1158)


   

(3S)-3-(1-methylindol-3-yl)butan-1-ol

(3S)-3-(1-methylindol-3-yl)butan-1-ol

C13H17NO (203.131)


   

Carbamic acid, (3-hydroxy-1,1-dimethylpropyl)-, 1,1-dimethylethyl ester (9CI)

Carbamic acid, (3-hydroxy-1,1-dimethylpropyl)-, 1,1-dimethylethyl ester (9CI)

C10H21NO3 (203.1521)


   

4-(3-phenylpropyl)piperidine

4-(3-phenylpropyl)piperidine

C14H21N (203.1674)


   

H-D-Glu-OtBu

(R)-4-Amino-5-(tert-butoxy)-5-oxopentanoic acid

C9H17NO4 (203.1158)


   

Boc-L-β-homoalanine

Boc-L-β-homoalanine

C9H17NO4 (203.1158)


   

1,3,7-tris(trideuteriomethyl)purine-2,6-dione

1,3,7-tris(trideuteriomethyl)purine-2,6-dione

C8HD9N4O2 (203.1369)


   

2-Methyl-L-aspartic acid 4-(1,1-dimethylethyl) ester

2-Methyl-L-aspartic acid 4-(1,1-dimethylethyl) ester

C9H17NO4 (203.1158)


   

3,4-Dihydrospiro[chromene-2,4-piperidine]

3,4-Dihydrospiro[chromene-2,4-piperidine]

C13H17NO (203.131)


   

1-Benzyl-4-azepanone

1-Benzyl-4-azepanone

C13H17NO (203.131)


   

Boc-L-2-aminobutyric acid

Boc-L-2-aminobutyric acid

C9H17NO4 (203.1158)


   

Boc-GABA-OH

Boc-GABA-OH

C9H17NO4 (203.1158)


   

2-(3,5-DIMETHYL-PHENYL)-AZEPANE

2-(3,5-DIMETHYL-PHENYL)-AZEPANE

C14H21N (203.1674)


   

9H-Purine,6-(1-piperidinyl)-

9H-Purine,6-(1-piperidinyl)-

C10H13N5 (203.1171)


   

4-Amino-2-(1-piperidinyl)pyrimidine-5-carbonitrile

4-Amino-2-(1-piperidinyl)pyrimidine-5-carbonitrile

C10H13N5 (203.1171)


   

UNII:4956DJR58O

Mecamylamine hydrochloride

C11H22ClN (203.1441)


C78272 - Agent Affecting Nervous System > C66880 - Anticholinergic Agent > C66886 - Nicotinic Antagonist Mecamylamine hydrochloride is an orally active, nonselective, noncompetitive nAChR antagonist. Mecamylamine hydrochloride is also a ganglionic blocker. Mecamylamine hydrochloride can across the blood-brain barrier. Mecamylamine hydrochloride can be used in the research of neuropsychiatric disorders, hypertension, antidepressant area[1][2][5].

   

N,N-Bis(trimethylsilyl)acetamide

N,N-Bis(trimethylsilyl)acetamide

C8H21NOSi2 (203.1162)


   

Boc-D-Abu-OH

Boc-D-Abu-OH

C9H17NO4 (203.1158)


   

3-((tert-Butoxycarbonyl)amino)butanoic acid

3-((tert-Butoxycarbonyl)amino)butanoic acid

C9H17NO4 (203.1158)


   

Boc-DL-3-Aminoisobutyric acid

Boc-DL-3-Aminoisobutyric acid

C9H17NO4 (203.1158)


   

1-benzyl-2-methylpiperidin-4-one

1-benzyl-2-methylpiperidin-4-one

C13H17NO (203.131)


   

(S)-2-(1,6,7,8-Tetrahydro-2H-indeno[5,4-b]furan-8-yl)ethylamine

(S)-2-(1,6,7,8-Tetrahydro-2H-indeno[5,4-b]furan-8-yl)ethylamine

C13H17NO (203.131)


   

3H-SPIRO[AZEPANE-4,1-ISOBENZOFURAN]

3H-SPIRO[AZEPANE-4,1-ISOBENZOFURAN]

C13H17NO (203.131)


   

2-(4-(Pentyloxy)phenyl)acetonitrile

2-(4-(Pentyloxy)phenyl)acetonitrile

C13H17NO (203.131)


   

3-[2-(Dimethylamino)ethyl]-1H-indol-5-amine

3-[2-(Dimethylamino)ethyl]-1H-indol-5-amine

C12H17N3 (203.1422)


   

2-CYCLOHEXYL-2-NITRO-1,3-PROPANEDIOL

2-CYCLOHEXYL-2-NITRO-1,3-PROPANEDIOL

C9H17NO4 (203.1158)


   

Triethylmethylammonium Tetrafluoroborate

Triethylmethylammonium Tetrafluoroborate

C7H18BF4N (203.1468)


   

H-Glu(OtBu)-OH

H-Glu(OtBu)-OH

C9H17NO4 (203.1158)


   

4-((e)-3-phenyl-allyl)-morpholine

4-((e)-3-phenyl-allyl)-morpholine

C13H17NO (203.131)


   

N,N-diethyl-4-phenylbut-3-en-1-amine

N,N-diethyl-4-phenylbut-3-en-1-amine

C14H21N (203.1674)


   

tert-butyl 4-fluoropiperidine-1-carboxylate

tert-butyl 4-fluoropiperidine-1-carboxylate

C10H18FNO2 (203.1322)


   

N-Boc-glycine Ethyl Ester

N-Boc-glycine Ethyl Ester

C9H17NO4 (203.1158)


   

(R)-3-(tert-Butoxycarbonylamino)butanoic acid

(R)-3-(tert-Butoxycarbonylamino)butanoic acid

C9H17NO4 (203.1158)


   

Boc-D-Alanine Methyl Ester

Boc-D-Alanine Methyl Ester

C9H17NO4 (203.1158)


   

N,N-dimethyl-1-phenylcyclohexan-1-amine

N,N-dimethyl-1-phenylcyclohexan-1-amine

C14H21N (203.1674)


   

Cyclopropanamine, 1-[3-(tetrahydro-2-furanyl)phenyl]

Cyclopropanamine, 1-[3-(tetrahydro-2-furanyl)phenyl]

C13H17NO (203.131)


   

Cyclopropanamine, 1-[3-(tetrahydro-3-furanyl)phenyl]

Cyclopropanamine, 1-[3-(tetrahydro-3-furanyl)phenyl]

C13H17NO (203.131)


   

1H-Pyrrolo[2,3-b]pyridine-3-methanamine,6-ethyl-N,N-dimethyl-(9CI)

1H-Pyrrolo[2,3-b]pyridine-3-methanamine,6-ethyl-N,N-dimethyl-(9CI)

C12H17N3 (203.1422)


   

3H-SPIRO[1-BENZOFURAN-2,4-(1-METHYLPIPERIDINE)]

3H-SPIRO[1-BENZOFURAN-2,4-(1-METHYLPIPERIDINE)]

C13H17NO (203.131)


   

TERT-BUTYL3-HYDROXY-2,2-DIMETHYLPROPYLCARBAMATE

TERT-BUTYL3-HYDROXY-2,2-DIMETHYLPROPYLCARBAMATE

C10H21NO3 (203.1521)


   

1-methyl-7-pyridin-3-yl-1,7-diazaspiro[3.4]octane

1-methyl-7-pyridin-3-yl-1,7-diazaspiro[3.4]octane

C12H17N3 (203.1422)


   

(S)-(-)-2-(a-(i-butyl)methanamine)-1H-benzimidazole, min. 98 (S)-i-Bu-BIMAH

(S)-(-)-2-(a-(i-butyl)methanamine)-1H-benzimidazole, min. 98 (S)-i-Bu-BIMAH

C12H17N3 (203.1422)


   

1-(1-BENZYL-PYRROLIDIN-3-YL)-ETHANON

1-(1-BENZYL-PYRROLIDIN-3-YL)-ETHANON

C13H17NO (203.131)


   

N-benzyl-1-cyclohexylmethanamine

N-benzyl-1-cyclohexylmethanamine

C14H21N (203.1674)


   

N,O-Bis(trimethylsilyl)acetamide

N,O-Bis(trimethylsilyl)acetamide

C8H21NOSi2 (203.1162)


   

2-(3alpha-Propan-2-yl-3-indolyl)ethanol

2-(3alpha-Propan-2-yl-3-indolyl)ethanol

C13H17NO (203.131)


   
   

tert-Butyl (3-hydrazino-3-oxopropyl)carbamate

tert-Butyl (3-hydrazino-3-oxopropyl)carbamate

C8H17N3O3 (203.127)


   

3-tert-Butoxycarbonylamino-2-methyl-propionic acid

3-tert-Butoxycarbonylamino-2-methyl-propionic acid

C9H17NO4 (203.1158)


   

ANTI-7-HYDROXY-2-BENZYL-2-AZABICYCLO2.2.1HEPTANE

ANTI-7-HYDROXY-2-BENZYL-2-AZABICYCLO2.2.1HEPTANE

C13H17NO (203.131)


   

tert-Butyl [(3Z)-3-amino-3-(hydroxyimino)propyl]-carbamate

tert-Butyl [(3Z)-3-amino-3-(hydroxyimino)propyl]-carbamate

C8H17N3O3 (203.127)


   

(3-TERT-BUTYL-1-METHYL-1H-PYRAZOL-5-YL)METHANAMINEHYDROCHLORIDE

(3-TERT-BUTYL-1-METHYL-1H-PYRAZOL-5-YL)METHANAMINEHYDROCHLORIDE

C9H18ClN3 (203.1189)


   

4-Piperidinoacetophenone

4-Piperidinoacetophenone

C13H17NO (203.131)


   

4-(piperidin-1-ylmethyl)benzaldehyde

4-(piperidin-1-ylmethyl)benzaldehyde

C13H17NO (203.131)


   

4-Octyl-3-thiosemicarbazide

4-Octyl-3-thiosemicarbazide

C9H21N3S (203.1456)


   

3-(PIPERIDINOMETHYL)BENZALDEHYDE

3-(PIPERIDINOMETHYL)BENZALDEHYDE

C13H17NO (203.131)


   

N-(tert-Butoxycarbonyl)-N-methyl-β-alanine

N-(tert-Butoxycarbonyl)-N-methyl-β-alanine

C9H17NO4 (203.1158)


   

(2-HYDROXYPHENYL)(ISOXAZOL-4-YL)METHANONE

(2-HYDROXYPHENYL)(ISOXAZOL-4-YL)METHANONE

C9H17NO4 (203.1158)


   

(2R)-4-(1H-Indol-3-yl)-2-methyl-1-butanol

(2R)-4-(1H-Indol-3-yl)-2-methyl-1-butanol

C13H17NO (203.131)


   

3-Benzyl-8-oxa-3-azabicyclo[3.2.1]octane

3-Benzyl-8-oxa-3-azabicyclo[3.2.1]octane

C13H17NO (203.131)


   

Boc-N-Me-Ala-OH

Boc-N-Me-Ala-OH

C9H17NO4 (203.1158)


   

2-Ethoxy-4-(2-methyl-2-propanyl)benzonitrile

2-Ethoxy-4-(2-methyl-2-propanyl)benzonitrile

C13H17NO (203.131)


   

4-(2,2-Diethoxyethyl)morpholine

4-(2,2-Diethoxyethyl)morpholine

C10H21NO3 (203.1521)


   

2,6-di-iso-propylphenyl isocyanate

2,6-di-iso-propylphenyl isocyanate

C13H17NO (203.131)


   

N-ME-ASP(OTBU)-OH

N-ME-ASP(OTBU)-OH

C9H17NO4 (203.1158)


   

Boc-Ala-Ome

Boc-Ala-Ome

C9H17NO4 (203.1158)


   

Benzenamine, 3-ethyl-5-(1-methyl-1H-tetrazol-5-yl)- (9CI)

Benzenamine, 3-ethyl-5-(1-methyl-1H-tetrazol-5-yl)- (9CI)

C10H13N5 (203.1171)


   

1-Oxa-6-azaspiro[2.5]octane,6-(phenylmethyl)-

1-Oxa-6-azaspiro[2.5]octane,6-(phenylmethyl)-

C13H17NO (203.131)


   
   

2-AMINO-1-(BUTYLDIMETHYLSILOXY)BUTANE

2-AMINO-1-(BUTYLDIMETHYLSILOXY)BUTANE

C10H25NOSi (203.1705)


   

1H-Azepine,2-(4-ethylphenyl)hexahydro-(9CI)

1H-Azepine,2-(4-ethylphenyl)hexahydro-(9CI)

C14H21N (203.1674)


   

diethyl glutamate

diethyl glutamate

C9H17NO4 (203.1158)


   

2-(2-ethylphenyl)azepane

2-(2-ethylphenyl)azepane

C14H21N (203.1674)


   

5,5,8,8-Tetramethyl-5,6,7,8-tetrahydronaphthalen-2-ylamine

5,5,8,8-Tetramethyl-5,6,7,8-tetrahydronaphthalen-2-ylamine

C14H21N (203.1674)


   

1-Phenyl-3-(1-pyrrolidinyl)-1-propanone

1-Phenyl-3-(1-pyrrolidinyl)-1-propanone

C13H17NO (203.131)


   
   

4-(2-p-Tolyl-ethyl)-piperidine

4-(2-p-Tolyl-ethyl)-piperidine

C14H21N (203.1674)


   

5-(boc-amino)-1-pentanol

5-(boc-amino)-1-pentanol

C10H21NO3 (203.1521)


   

trans-4-(Diethylamino)cinnamaldehyde

trans-4-(Diethylamino)cinnamaldehyde

C13H17NO (203.131)


   

3,4-dihydroxy-pyrrolidine-1-carboxylic acid tert-butyl ester

3,4-dihydroxy-pyrrolidine-1-carboxylic acid tert-butyl ester

C9H17NO4 (203.1158)


   

(3R,4S)-tert-Butyl 3,4-dihydroxypyrrolidine-1-carboxylate

(3R,4S)-tert-Butyl 3,4-dihydroxypyrrolidine-1-carboxylate

C9H17NO4 (203.1158)


   

(S)-N-tert-butoxycarbonyl-N-methyl-2-amino-propionic acid

(S)-N-tert-butoxycarbonyl-N-methyl-2-amino-propionic acid

C9H17NO4 (203.1158)


   

(3R)-(-)-3-(1-Methyl-1H-Indol-3-yl)-1-Butanol

(3R)-(-)-3-(1-Methyl-1H-Indol-3-yl)-1-Butanol

C13H17NO (203.131)


   

2-(2,6,7,8-tetrahydro-1H-cyclopenta[e][1]benzofuran-8-yl)ethanamine

2-(2,6,7,8-tetrahydro-1H-cyclopenta[e][1]benzofuran-8-yl)ethanamine

C13H17NO (203.131)


   

2-(7-methoxy-3,4-dihydronaphthalen-1-yl)ethan-1-amine

2-(7-methoxy-3,4-dihydronaphthalen-1-yl)ethan-1-amine

C13H17NO (203.131)


   

(E)-2-(7-methoxy-3,4-dihydronaphthalen-1(2H)-ylidene)ethan-1-amine

(E)-2-(7-methoxy-3,4-dihydronaphthalen-1(2H)-ylidene)ethan-1-amine

C13H17NO (203.131)


   

trans-tert-butyl 4-hydroxytetrahydrofuran-3-ylcarbaMate

trans-tert-butyl 4-hydroxytetrahydrofuran-3-ylcarbaMate

C9H17NO4 (203.1158)


   

N-(1-Methylethyl)-N-(phenylmethyl)-2-propenamide

N-(1-Methylethyl)-N-(phenylmethyl)-2-propenamide

C13H17NO (203.131)


   

1-ISOPROPYL-1,2,3,4-TETRAHYDRO-QUINOLINE-6-CARBALDEHYDE

1-ISOPROPYL-1,2,3,4-TETRAHYDRO-QUINOLINE-6-CARBALDEHYDE

C13H17NO (203.131)


   

N-Boc-N-methylglycine methyl ester

N-Boc-N-methylglycine methyl ester

C9H17NO4 (203.1158)


   

TERT-BUTYL (2-HYDRAZINYL-2-OXOETHYL)(METHYL)CARBAMATE

TERT-BUTYL (2-HYDRAZINYL-2-OXOETHYL)(METHYL)CARBAMATE

C8H17N3O3 (203.127)


   

4-amino-3-(tert-butylamino)-2-methylbenzonitrile

4-amino-3-(tert-butylamino)-2-methylbenzonitrile

C12H17N3 (203.1422)


   

1-Benzylpiperidine-4-carbaldehyde

1-Benzylpiperidine-4-carbaldehyde

C13H17NO (203.131)


   

1-Phenethyl-4-piperidone

1-Phenethyl-4-piperidone

C13H17NO (203.131)


   

2-METHYL-4-PIPERIDIN-1-YL-BENZALDEHYDE

2-METHYL-4-PIPERIDIN-1-YL-BENZALDEHYDE

C13H17NO (203.131)


   

Boc-(R)-3-Amino-2-methylpropanoic acid

Boc-(R)-3-Amino-2-methylpropanoic acid

C9H17NO4 (203.1158)


   
   

D-Glutamic acid, 5-(1,1-dimethylethyl) ester

D-Glutamic acid, 5-(1,1-dimethylethyl) ester

C9H17NO4 (203.1158)


   

7-Methoxy-2,2,4-trimethyl-1,2-dihydroquinoline

7-Methoxy-2,2,4-trimethyl-1,2-dihydroquinoline

C13H17NO (203.131)


   

1H-Inden-1-one,2-amino-2,3-dihydro-4,5,6,7-tetramethyl-(9CI)

1H-Inden-1-one,2-amino-2,3-dihydro-4,5,6,7-tetramethyl-(9CI)

C13H17NO (203.131)


   

N1-Boc-2,2-iminodiethylamine

N1-Boc-2,2-iminodiethylamine

C9H21N3O2 (203.1634)


   

2,6-DICHLORO-4-NITROANISOLE

2,6-DICHLORO-4-NITROANISOLE

C13H17NO (203.131)


   

(3S,4S)-tert-Butyl 3,4-dihydroxypyrrolidine-1-carboxylate

(3S,4S)-tert-Butyl 3,4-dihydroxypyrrolidine-1-carboxylate

C9H17NO4 (203.1158)


   

4-Benzylaminocyclohexanone

4-Benzylaminocyclohexanone

C13H17NO (203.131)


   

(2R,4R)-2-AMINO-4-BUTYL-PENTANEDIOIC ACID

(2R,4R)-2-AMINO-4-BUTYL-PENTANEDIOIC ACID

C9H17NO4 (203.1158)


   

1-Benzyl-3-methyl-4-piperidinone

1-Benzyl-3-methyl-4-piperidinone

C13H17NO (203.131)


   

2-(3,4-Dimethylphenyl)azepane

2-(3,4-Dimethylphenyl)azepane

C14H21N (203.1674)


   

N-Boc-D-Valinol

N-Boc-D-Valinol

C10H21NO3 (203.1521)


   

5-(tert-Butyl)-2-ethylbenzoxazole

5-(tert-Butyl)-2-ethylbenzoxazole

C13H17NO (203.131)


   

Spiro[isochroman-1,4-piperidine]

Spiro[isochroman-1,4-piperidine]

C13H17NO (203.131)


   

Dexmecamylamine hydrochloride

Dexmecamylamine hydrochloride

C11H22ClN (203.1441)


C78272 - Agent Affecting Nervous System > C66880 - Anticholinergic Agent > C66886 - Nicotinic Antagonist

   

Diethyl 2-aminopentanedioate

Diethyl 2-aminopentanedioate

C9H17NO4 (203.1158)


D018377 - Neurotransmitter Agents > D018683 - Excitatory Amino Acid Agents > D018691 - Excitatory Amino Acid Antagonists D002491 - Central Nervous System Agents > D011619 - Psychotropic Drugs D002491 - Central Nervous System Agents > D000927 - Anticonvulsants

   

S-(2-(N,N-Diisopropylamino)ethyl)isothiourea

S-(2-(N,N-Diisopropylamino)ethyl)isothiourea

C9H21N3S (203.1456)


   

Glycyllysine

Glycyllysine

C8H17N3O3 (203.127)


   

3-(Methoxycarbonylamino)-2,2,3-trimethylbutanoic acid

3-(Methoxycarbonylamino)-2,2,3-trimethylbutanoic acid

C9H17NO4 (203.1158)


   

Glycyl-isolysine

Glycyl-isolysine

C8H17N3O3 (203.127)


   

Benzenamine, N-(cyclohexylmethyl)-N-methyl-

Benzenamine, N-(cyclohexylmethyl)-N-methyl-

C14H21N (203.1674)


   

N-(ethoxycarbonyl)-L-leucine

N-(ethoxycarbonyl)-L-leucine

C9H17NO4 (203.1158)


   

2-(Acetyl-hydroxy-amino)-4-methyl-pentanoic acid methyl ester

2-(Acetyl-hydroxy-amino)-4-methyl-pentanoic acid methyl ester

C9H17NO4 (203.1158)


   

N6-dimethylallyladenine

6-(γ,γ-Dimethylallylamino)purine

C10H13N5 (203.1171)


N-(3-methylbut-2-en-1-yl)-9h-purin-6-amine, also known as isopentenyladenine or ip, is a member of the class of compounds known as 6-alkylaminopurines. 6-alkylaminopurines are compounds that contain an alkylamine group attached at the 6-position of a purine. Purine is a bicyclic aromatic compound made up of a pyrimidine ring fused to an imidazole ring. N-(3-methylbut-2-en-1-yl)-9h-purin-6-amine is practically insoluble (in water) and a very weakly acidic compound (based on its pKa). N-(3-methylbut-2-en-1-yl)-9h-purin-6-amine can be found in a number of food items such as sorghum, green zucchini, enokitake, and star fruit, which makes N-(3-methylbut-2-en-1-yl)-9h-purin-6-amine a potential biomarker for the consumption of these food products. 6-(γ,γ-Dimethylallylamino)purine is a plant growth substance. 6-(γ,γ-Dimethylallylamino)purine is a plant growth substance.

   

N-(3-methylbut-2-enyl)-3,5-dihydropurin-6-imine

N-(3-methylbut-2-enyl)-3,5-dihydropurin-6-imine

C10H13N5 (203.1171)


   

9-(Methylsulfanyl)nonanal oxime

9-(Methylsulfanyl)nonanal oxime

C10H21NOS (203.1344)


   

1-(2-Phenylpropan-2-yl)piperidine

1-(2-Phenylpropan-2-yl)piperidine

C14H21N (203.1674)


   

N(omega),N(omega)-dimethyl-L-argininium

N(omega),N(omega)-dimethyl-L-argininium

C8H19N4O2+ (203.1508)


   

N(alpha)-acetyl-L-lysine methyl ester(1+)

N(alpha)-acetyl-L-lysine methyl ester(1+)

C9H19N2O3+ (203.1396)


   

(2S)-2-Amino-8-hydroxydecanoic acid

(2S)-2-Amino-8-hydroxydecanoic acid

C10H21NO3 (203.1521)


   

[amino-[[(4S)-4-amino-4-carboxybutyl]amino]methylidene]-dimethylazanium

[amino-[[(4S)-4-amino-4-carboxybutyl]amino]methylidene]-dimethylazanium

C8H19N4O2+ (203.1508)


   

(2S,3R,4S,5R,6R)-6-methyl-4-(prop-1-en-2-ylamino)oxane-2,3,5-triol

(2S,3R,4S,5R,6R)-6-methyl-4-(prop-1-en-2-ylamino)oxane-2,3,5-triol

C9H17NO4 (203.1158)


   

(2S,8R)-2-amino-8-hydroxydecanoic acid

(2S,8R)-2-amino-8-hydroxydecanoic acid

C10H21NO3 (203.1521)


   

1-Carboxyethylleucine

1-Carboxyethylleucine

C9H17NO4 (203.1158)


   

3-methyl-N-(2-phenylethyl)-2-butenamide

3-methyl-N-(2-phenylethyl)-2-butenamide

C13H17NO (203.131)


   

L-Leucine, trimethylsilyl ester

L-Leucine, trimethylsilyl ester

C9H21NO2Si (203.1341)


   

l-Isoleucine, trimethylsilyl ester

l-Isoleucine, trimethylsilyl ester

C9H21NO2Si (203.1341)


   

3-Methyl-6-(1-pyrrolidinyl)-[1,2,4]triazolo[4,3-b]pyridazine

3-Methyl-6-(1-pyrrolidinyl)-[1,2,4]triazolo[4,3-b]pyridazine

C10H13N5 (203.1171)


   

(2S)-2-azaniumyl-5-[[methylamino(methylazaniumylidene)methyl]amino]pentanoate

(2S)-2-azaniumyl-5-[[methylamino(methylazaniumylidene)methyl]amino]pentanoate

C8H19N4O2+ (203.1508)


   

Glutamic acid butyl ester

Glutamic acid butyl ester

C9H17NO4 (203.1158)


   

Methyl 2-(2-hydroxypropanoylamino)-3-methylbutanoate

Methyl 2-(2-hydroxypropanoylamino)-3-methylbutanoate

C9H17NO4 (203.1158)


   

N(epsilon)-carbamoylmethyllysine

N(epsilon)-carbamoylmethyllysine

C8H17N3O3 (203.127)


   

2-[(2R,5S,6S)-5-amino-6-(hydroxymethyl)-2-oxanyl]acetic acid methyl ester

2-[(2R,5S,6S)-5-amino-6-(hydroxymethyl)-2-oxanyl]acetic acid methyl ester

C9H17NO4 (203.1158)


   

2-[(2R,5R,6S)-5-amino-6-(hydroxymethyl)-2-oxanyl]acetic acid methyl ester

2-[(2R,5R,6S)-5-amino-6-(hydroxymethyl)-2-oxanyl]acetic acid methyl ester

C9H17NO4 (203.1158)


   

2-[(2R,5R,6R)-5-amino-6-(hydroxymethyl)-2-oxanyl]acetic acid methyl ester

2-[(2R,5R,6R)-5-amino-6-(hydroxymethyl)-2-oxanyl]acetic acid methyl ester

C9H17NO4 (203.1158)


   

beta-Alanyl-ornithine

beta-Alanyl-ornithine

C8H17N3O3 (203.127)


   

(3R)-3-[(2,2,2-2H3)acetyloxy]-4-(trimethylazaniumyl)butanoate

(3R)-3-[(2,2,2-2H3)acetyloxy]-4-(trimethylazaniumyl)butanoate

C9H17NO4 (203.1158)


   

N-[(4-aminophenyl)methyl]-2,3,4,5-tetrahydropyridin-6-amine

N-[(4-aminophenyl)methyl]-2,3,4,5-tetrahydropyridin-6-amine

C12H17N3 (203.1422)


   

4-(Dimethylamino)butyric acid, TMS derivative

4-(Dimethylamino)butyric acid, TMS derivative

C9H21NO2Si (203.1341)


   

N-[2-Methyl-1-(trimethylsilyloxy)propan-2-yl]acetamide

N-[2-Methyl-1-(trimethylsilyloxy)propan-2-yl]acetamide

C9H21NO2Si (203.1341)


   

N-(1,3-dihydroxyoctan-2-yl)acetamide

N-(1,3-dihydroxyoctan-2-yl)acetamide

C10H21NO3 (203.1521)


   

5-(2-Cyclohexylethyl)-2-methylpyridine

5-(2-Cyclohexylethyl)-2-methylpyridine

C14H21N (203.1674)


   
   
   

N(6)-dimethylallyladenine

N-(3-Methylbut-2-EN-1-YL)-9H-purin-6-amine

C10H13N5 (203.1171)


A 6-isopentenylaminopurine in which has the isopentenyl double bond is located between the 2 and 3 positions of the isopentenyl group. D006133 - Growth Substances > D010937 - Plant Growth Regulators > D003583 - Cytokinins 6-(γ,γ-Dimethylallylamino)purine is a plant growth substance. 6-(γ,γ-Dimethylallylamino)purine is a plant growth substance.

   

Acetyl-L-carnitine

O-Acetyl-L-carnitine

C9H17NO4 (203.1158)


N - Nervous system > N06 - Psychoanaleptics > N06B - Psychostimulants, agents used for adhd and nootropics COVID info from COVID-19 Disease Map, clinicaltrial, clinicaltrials, clinical trial, clinical trials D002491 - Central Nervous System Agents > D018697 - Nootropic Agents D018977 - Micronutrients > D014815 - Vitamins Corona-virus Coronavirus SARS-CoV-2 COVID-19 SARS-CoV COVID19 SARS2 SARS

   

Lysylglycine

Lysylglycine

C8H17N3O3 (203.127)


   

O-acetyl-D-carnitine

O-acetyl-D-carnitine

C9H17NO4 (203.1158)


An O-acyl-D-carnitine in which the acyl group specified is acetyl.

   

lysyl-glycine

lysyl-glycine

C8H17N3O3 (203.127)


   

N-Lactoyl-leucine

N-Lactoyl-leucine

C9H17NO4 (203.1158)


   

N(6)-glycyl-L-lysine

N(6)-glycyl-L-lysine

C8H17N3O3 (203.127)


A L-lysine derivative with a glycyl group at the N(6)-position.

   

N(omega),N(omega)-dimethyl-L-argininium(1+)

N(omega),N(omega)-dimethyl-L-argininium(1+)

C8H19N4O2 (203.1508)


An alpha-amino-acid cation that is the conjugate acid of N(omega),N(omega)-dimethyl-L-arginine, arising from deprotonation of the carboxy group and protonation of the primary amino and imino groups; major species at pH 7.3.

   
   
   

Carboxyethylisoleucine

Carboxyethylisoleucine

C9H17NO4 (203.1158)


   

Carboxyethylleucine

Carboxyethylleucine

C9H17NO4 (203.1158)


   

N-Lactoyl isoleucine

N-Lactoyl isoleucine

C9H17NO4 (203.1158)


   

N-Lactoyl leucine

N-Lactoyl leucine

C9H17NO4 (203.1158)


   

Methylthiononanaldoxime

Methylthiononanaldoxime

C10H21NOS (203.1344)


   

ALDH1A3-IN-2

ALDH1A3-IN-2

C13H17NO (203.131)


ALDH1A3-IN-2 (Compound 15) is a potent inhibitor of ALDH1A3 with an IC50 of 1.29 μM. Aldehyde dehydrogenases (ALDHs) are overexpressed in various tumor types including prostate cancer. ALDH1A3-IN-2 has the potential for the research of cancer diseases[1].

   

Valiloxibic acid

Valiloxibic acid

C9H17NO4 (203.1158)


Valiloxibic acid is a proagent of γ-Hydroxybutyric acid (GHB).GHB is a naturally occurring neurotransmitter and a psychoactive agent, it acts on the GHB receptor and is a weak agonist at the GABAB receptor[1].

   

2-(3-methylbut-3-en-1-yl)-3h-purin-6-amine

2-(3-methylbut-3-en-1-yl)-3h-purin-6-amine

C10H13N5 (203.1171)


   

9-(3-methylbut-2-en-1-yl)purin-6-amine

9-(3-methylbut-2-en-1-yl)purin-6-amine

C10H13N5 (203.1171)


   

(1s,2s,3r,5r,7s,7ar)-3-(hydroxymethyl)-5-methyl-hexahydro-1h-pyrrolizine-1,2,7-triol

(1s,2s,3r,5r,7s,7ar)-3-(hydroxymethyl)-5-methyl-hexahydro-1h-pyrrolizine-1,2,7-triol

C9H17NO4 (203.1158)


   

3-(hydroxymethyl)-5-methyl-hexahydro-1h-pyrrolizine-1,2,7-triol

3-(hydroxymethyl)-5-methyl-hexahydro-1h-pyrrolizine-1,2,7-triol

C9H17NO4 (203.1158)


   

(1r,2r,3r,5r,7ar)-3,5-bis(hydroxymethyl)-hexahydro-1h-pyrrolizine-1,2-diol

(1r,2r,3r,5r,7ar)-3,5-bis(hydroxymethyl)-hexahydro-1h-pyrrolizine-1,2-diol

C9H17NO4 (203.1158)


   

(1s,2r,3r,5s,7r,7ar)-3-(hydroxymethyl)-5-methyl-hexahydro-1h-pyrrolizine-1,2,7-triol

(1s,2r,3r,5s,7r,7ar)-3-(hydroxymethyl)-5-methyl-hexahydro-1h-pyrrolizine-1,2,7-triol

C9H17NO4 (203.1158)


   

(1s,9s)-1,10-dimethyl-10-azatricyclo[7.2.1.0²,⁷]dodeca-2,4,6-trien-4-ol

(1s,9s)-1,10-dimethyl-10-azatricyclo[7.2.1.0²,⁷]dodeca-2,4,6-trien-4-ol

C13H17NO (203.131)


   

2,6-Nonamethylene pyridine

2,6-nonamethylene pyridine; AC1NSZ5U; 15-azabicyclo[9.3.1]pentadeca-1(15),11,13-triene

C14H21N (203.1674)


{"Ingredient_id": "HBIN004958","Ingredient_name": "2,6-Nonamethylene pyridine","Alias": "2,6-nonamethylene pyridine; AC1NSZ5U; 15-azabicyclo[9.3.1]pentadeca-1(15),11,13-triene","Ingredient_formula": "C14H21N","Ingredient_Smile": "C1CCCCC2=NC(=CC=C2)CCCC1","Ingredient_weight": "203.36","OB_score": "68.93503493","CAS_id": "NA","SymMap_id": "SMIT01084","TCMID_id": "15673","TCMSP_id": "MOL002476","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}

   

(2z)-n-(2-methylpropyl)non-2-en-6,8-diynimidic acid

(2z)-n-(2-methylpropyl)non-2-en-6,8-diynimidic acid

C13H17NO (203.131)


   
   

n-(2-methylpropyl)-3-phenylprop-2-enimidic acid

n-(2-methylpropyl)-3-phenylprop-2-enimidic acid

C13H17NO (203.131)


   

(2r)-4-(1h-indol-3-yl)-2-methylbutan-1-ol

(2r)-4-(1h-indol-3-yl)-2-methylbutan-1-ol

C13H17NO (203.131)


   

pentyl(3-phenylprop-2-en-1-yl)amine

pentyl(3-phenylprop-2-en-1-yl)amine

C14H21N (203.1674)


   

1-(3-methylbut-2-en-1-yl)purin-6-amine

1-(3-methylbut-2-en-1-yl)purin-6-amine

C10H13N5 (203.1171)


   

(1s,2r,3r,5r,7r,7ar)-3-(hydroxymethyl)-5-methyl-hexahydro-1h-pyrrolizine-1,2,7-triol

(1s,2r,3r,5r,7r,7ar)-3-(hydroxymethyl)-5-methyl-hexahydro-1h-pyrrolizine-1,2,7-triol

C9H17NO4 (203.1158)


   

1-phenyl-2-[(2s)-piperidin-2-yl]ethanone

1-phenyl-2-[(2s)-piperidin-2-yl]ethanone

C13H17NO (203.131)


   

1,10-dimethyl-10-azatricyclo[7.2.1.0²,⁷]dodeca-2,4,6-trien-4-ol

1,10-dimethyl-10-azatricyclo[7.2.1.0²,⁷]dodeca-2,4,6-trien-4-ol

C13H17NO (203.131)


   

(1s,2r,3r,5r,7s,7ar)-3-(hydroxymethyl)-5-methyl-hexahydro-1h-pyrrolizine-1,2,7-triol

(1s,2r,3r,5r,7s,7ar)-3-(hydroxymethyl)-5-methyl-hexahydro-1h-pyrrolizine-1,2,7-triol

C9H17NO4 (203.1158)


   

3,5-bis(hydroxymethyl)-hexahydro-1h-pyrrolizine-1,2-diol

3,5-bis(hydroxymethyl)-hexahydro-1h-pyrrolizine-1,2-diol

C9H17NO4 (203.1158)


   

5-[(2,4-dimethylphenyl)methyl]-4,5-dihydro-3h-pyrrol-2-ol

5-[(2,4-dimethylphenyl)methyl]-4,5-dihydro-3h-pyrrol-2-ol

C13H17NO (203.131)


   

3-hydroxy-4-oxo-3-[(trimethylammonio)methyl]pentanoate

3-hydroxy-4-oxo-3-[(trimethylammonio)methyl]pentanoate

C9H17NO4 (203.1158)


   

4-(1h-indol-3-yl)-2-methylbutan-1-ol

4-(1h-indol-3-yl)-2-methylbutan-1-ol

C13H17NO (203.131)


   

2-(3-methylbut-1-en-1-yl)-3h-purin-6-amine

2-(3-methylbut-1-en-1-yl)-3h-purin-6-amine

C10H13N5 (203.1171)


   

(1r,2r,3r,5r,7s,7ar)-3-(hydroxymethyl)-5-methyl-hexahydro-1h-pyrrolizine-1,2,7-triol

(1r,2r,3r,5r,7s,7ar)-3-(hydroxymethyl)-5-methyl-hexahydro-1h-pyrrolizine-1,2,7-triol

C9H17NO4 (203.1158)


   

6-(3-methylbut-3-en-1-yl)purin-6-amine

6-(3-methylbut-3-en-1-yl)purin-6-amine

C10H13N5 (203.1171)


   

(2s)-4-(1h-indol-3-yl)-2-methylbutan-1-ol

(2s)-4-(1h-indol-3-yl)-2-methylbutan-1-ol

C13H17NO (203.131)


   

1-phenyl-2-(piperidin-2-yl)ethanone

1-phenyl-2-(piperidin-2-yl)ethanone

C13H17NO (203.131)


   

3-(3-methylbut-2-en-1-yl)-9h-purin-6-imine

3-(3-methylbut-2-en-1-yl)-9h-purin-6-imine

C10H13N5 (203.1171)


   

n-(2-methylpropyl)non-2-en-6,8-diynimidic acid

n-(2-methylpropyl)non-2-en-6,8-diynimidic acid

C13H17NO (203.131)