Exact Mass: 287.1521356

Exact Mass Matches: 287.1521356

Found 147 metabolites which its exact mass value is equals to given mass value 287.1521356, within given mass tolerance error 0.01 dalton. Try search metabolite list with more accurate mass tolerance error 0.001 dalton.

Galantamine

(1S,12S,14R)-9-methoxy-4-methyl-11-oxa-4-azatetracyclo[8.6.1.01,12.06,17]heptadeca-6(17),7,9,15-tetraen-14-ol

C17H21NO3 (287.1521356)


Galanthamine is a benzazepine alkaloid isolated from certain species of daffodils. It has a role as an antidote to curare poisoning, an EC 3.1.1.7 (acetylcholinesterase) inhibitor, a cholinergic drug, an EC 3.1.1.8 (cholinesterase) inhibitor and a plant metabolite. It is an organic heterotetracyclic compound, a tertiary amino compound, a benzazepine alkaloid and a benzazepine alkaloid fundamental parent. It is a conjugate base of a galanthamine(1+). Galantamine is a tertiary alkaloid and reversible, competitive inhibitor of the acetylcholinesterase (AChE) enzyme, which is a widely studied therapeutic target used in the treatment of Alzheimers disease. First characterized in the early 1950s, galantamine is a tertiary alkaloid that was extracted from botanical sources, such as Galanthus nivalis. Galantamine was first studied in paralytic and neuropathic conditions, such as myopathies and postpolio paralytic conditions, and for reversal of neuromuscular blockade. Following the discovery of its AChE-inhibiting properties, the cognitive effects of galantamine were studied in a wide variety of psychiatric disorders such as mild cognitive impairment, cognitive impairment in schizophrenia and bipolar disorder, and autism; however, re-development of the drug for Alzheimer’s disease did not commence until the early 1990s due to difficulties in extraction and synthesis. Galantamine blocks the breakdown of acetylcholine in the synaptic cleft, thereby increasing acetylcholine neurotransmission. It also acts as an allosteric modulator of the nicotinic receptor, giving its dual mechanism of action clinical significance. The drug was approved by the FDA in 2001 for the treatment of mild to moderate dementia of the Alzheimers type. As Alzheimers disease is a progressive neurodegenerative disorder, galantamine is not known to alter the course of the underlying dementing process. Galantamine works to block the enzyme responsible for the breakdown of acetylcholine in the synaptic cleft, thereby enhancing cholinergic neuron function and signalling. Under this hypothesized mechanism of action, the therapeutic effects of galantamine may decrease as the disease progression advances and fewer cholinergic neurons remain functionally intact. It is therefore not considered to be a disease-modifying drug. Galantamine is marketed under the brand name Razadyne, and is available as oral immediate- and extended-release tablets and solution. Galantamine is a Cholinesterase Inhibitor. The mechanism of action of galantamine is as a Cholinesterase Inhibitor. Galantamine is an oral acetylcholinesterase inhibitor used for therapy of Alzheimer disease. Galantamine is associated with a minimal rate of serum enzyme elevations during therapy and has not been implicated as a cause of clinically apparent liver injury. Galantamine is a natural product found in Pancratium trianthum, Lycoris sanguinea, and other organisms with data available. A benzazepine derived from norbelladine. It is found in GALANTHUS and other AMARYLLIDACEAE. It is a cholinesterase inhibitor that has been used to reverse the muscular effects of GALLAMINE TRIETHIODIDE and TUBOCURARINE and has been studied as a treatment for ALZHEIMER DISEASE and other central nervous system disorders. See also: Galantamine Hydrobromide (active moiety of). A benzazepine derived from norbelladine. It is found in galanthus and other amaryllidaceae. Galantamine is a cholinesterase inhibitor that has been used to reverse the muscular effects of gallamine triethiodide and tubocurarine, and has been studied as a treatment for Alzheimers disease and other central nervous system disorders. [PubChem] D018373 - Peripheral Nervous System Agents > D001337 - Autonomic Agents > D010277 - Parasympathomimetics D018377 - Neurotransmitter Agents > D018678 - Cholinergic Agents > D002800 - Cholinesterase Inhibitors N - Nervous system > N06 - Psychoanaleptics > N06D - Anti-dementia drugs > N06DA - Anticholinesterases D002491 - Central Nervous System Agents > D018697 - Nootropic Agents A benzazepine alkaloid isolated from certain species of daffodils. C471 - Enzyme Inhibitor > C47792 - Acetylcholinesterase Inhibitor D004791 - Enzyme Inhibitors Galanthamine is a potent acetylcholinesterase (AChE) inhibitor with an IC50 of 500 nM. Galanthamine is a potent acetylcholinesterase (AChE) inhibitor with an IC50 of 500 nM.

   

Mesembrenone

6H-Indol-6-one, 3a-(3,4-dimethoxyphenyl)-1,2,3,3a,7,7a-hexahydro-1-methyl-, (3aR-cis)-

C17H21NO3 (287.1521356)


Mesembrenone is a member of pyrrolidines. Mesembrenone is a natural product found in Bergeranthus scapiger, Oscularia deltoides, and other organisms with data available.

   

Etodolac

(1,8-Diethyl-1,3,4,9-tetrahydro-pyrano[3,4-b]indol-1-yl)-acetic acid

C17H21NO3 (287.1521356)


Etodolac is only found in individuals that have used or taken this drug. It is a non-steroidal anti-inflammatory drug (NSAID) with anti-inflammatory, analgesic and antipyretic properties. Its therapeutic effects are due to its ability to inhibit prostaglandin synthesis. It is indicated for relief of signs and symptoms of rheumatoid arthritis and osteoarthritis. Similar to other NSAIDs, the anti-inflammatory effects of etodolac result from inhibition of the enzyme cycooxygenase (COX). This decreases the synthesis of peripheral prostaglandins involved in mediating inflammation. Etodolac binds to the upper portion of the COX enzyme active site and prevents its substrate, arachidonic acid, from entering the active site. Etodolac was previously thought to be a non-selective COX inhibitor, but it is now known to be 5 – 50 times more selective for COX-2 than COX-1. Antipyresis may occur by central action on the hypothalamus, resulting in peripheral dilation, increased cutaneous blood flow, and subsequent heat loss. M - Musculo-skeletal system > M01 - Antiinflammatory and antirheumatic products > M01A - Antiinflammatory and antirheumatic products, non-steroids > M01AB - Acetic acid derivatives and related substances D018501 - Antirheumatic Agents > D000894 - Anti-Inflammatory Agents, Non-Steroidal > D016861 - Cyclooxygenase Inhibitors D004791 - Enzyme Inhibitors > D016861 - Cyclooxygenase Inhibitors > D052246 - Cyclooxygenase 2 Inhibitors C78272 - Agent Affecting Nervous System > C241 - Analgesic Agent > C2198 - Nonnarcotic Analgesic D006133 - Growth Substances > D010937 - Plant Growth Regulators > D007210 - Indoleacetic Acids D018373 - Peripheral Nervous System Agents > D018689 - Sensory System Agents D002491 - Central Nervous System Agents > D000700 - Analgesics D000893 - Anti-Inflammatory Agents KEIO_ID E034; [MS2] KO008956 KEIO_ID E034

   

Dihydromorphine

(1S,5R,13R,14S,17R)-4-methyl-12-oxa-4-azapentacyclo[9.6.1.0^{1,13}.0^{5,17}.0^{7,18}]octadeca-7(18),8,10-triene-10,14-diol

C17H21NO3 (287.1521356)


Dihydromorphine is a metabolite of Hydromorphone. Dihydromorphine is a semi-synthetic opioid structurally related to and derived from morphine. The 7,8-double bond in morphine is reduced to a single bond to get dihydromorphine. (Wikipedia) D002491 - Central Nervous System Agents > D002492 - Central Nervous System Depressants > D009294 - Narcotics D002492 - Central Nervous System Depressants > D009294 - Narcotics > D053610 - Opiate Alkaloids D018373 - Peripheral Nervous System Agents > D018689 - Sensory System Agents D002491 - Central Nervous System Agents > D000700 - Analgesics

   

Ritodrine

4-(2-{[(1R,2S)-1-hydroxy-1-(4-hydroxyphenyl)propan-2-yl]amino}ethyl)phenol

C17H21NO3 (287.1521356)


Ritodrine is only found in individuals that have used or taken this drug. It is an adrenergic beta-agonist used to control premature labor. [PubChem]Ritodrine is beta-2 adrenergic agonist. It binds to beta-2 adrenergic receptors on outer membrane of myometrial cell, activates adenyl cyclase to increase the level of cAMP which decreases intracellular calcium and leads to a decrease of uterine contractions. G - Genito urinary system and sex hormones > G02 - Other gynecologicals > G02C - Other gynecologicals > G02CA - Sympathomimetics, labour repressants D018373 - Peripheral Nervous System Agents > D001337 - Autonomic Agents > D013566 - Sympathomimetics D018377 - Neurotransmitter Agents > D018663 - Adrenergic Agents > D000322 - Adrenergic Agonists D012102 - Reproductive Control Agents > D015149 - Tocolytic Agents

   

NAc-AAA-ME

Methyl-N-acetyl-N-L-alanyl-N-L-alanyl alaninate

C12H21N3O5 (287.1481136)


   
   

Piperanine

(2E)-5-(2H-1,3-benzodioxol-5-yl)-1-(piperidin-1-yl)pent-2-en-1-one

C17H21NO3 (287.1521356)


Isolated from pepper. Piperanine is found in herbs and spices and pepper (spice). Piperanine is found in herbs and spices. Piperanine is isolated from pepper.

   

Feruperine

(2E,4Z)-5-(4-hydroxy-3-methoxyphenyl)-1-(piperidin-1-yl)penta-2,4-dien-1-one

C17H21NO3 (287.1521356)


Alkaloid from pepper (Piper nigrum) (Piperaceae). Feruperine is found in herbs and spices and pepper (spice). Feruperine is found in herbs and spices. Feruperine is an alkaloid from pepper (Piper nigrum) (Piperaceae).

   

Arginylhydroxyproline

(2S,4R)-1-[(2S)-2-amino-5-carbamimidamidopentanoyl]-4-hydroxypyrrolidine-2-carboxylic acid

C11H21N5O4 (287.15934660000005)


Arginylhydroxyproline is a dipeptide composed of arginine and hydroxyproline. 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.

   

Hydroxyprolyl-Arginine

5-Carbamimidamido-2-{[hydroxy(4-hydroxypyrrolidin-2-yl)methylidene]amino}pentanoate

C11H21N5O4 (287.15934660000005)


Hydroxyprolyl-Arginine is a dipeptide composed of hydroxyproline and arginine. 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.

   

Nordihydrocodeine

(1S,5R,14S)-10-methoxy-12-oxa-4-azapentacyclo[9.6.1.0¹,¹³.0⁵,¹⁷.0⁷,¹⁸]octadeca-7(18),8,10-trien-14-ol

C17H21NO3 (287.1521356)


Nordihydrocodeine belongs to the family of Morphinans. These are polycyclic compounds with a four-ring skeleton with three condensed six-member rings forming a partially hydrogenated phenanthrene moiety, one of which is aromatic while the two others are alicyclic.

   

6alpha-Hydroxy-hydromorphone

(14S)-4-methyl-12-oxa-4-azapentacyclo[9.6.1.0¹,¹³.0⁵,¹⁷.0⁷,¹⁸]octadeca-7(18),8,10-triene-10,14-diol

C17H21NO3 (287.1521356)


6alpha-Hydroxy-hydromorphone is a metabolite of hydromorphone. Hydromorphone, a more common synonym for dihydromorphinone, commonly a hydrochloride (brand names Palladone, Dilaudid, and numerous others) is a very potent centrally acting analgesic drug of the opioid class. It is a derivative of morphine, to be specific, a hydrogenated ketone thereof and, therefore, a semi-synthetic drug. It is, in medical terms, an opioid analgesic and, in legal terms, a narcotic. (Wikipedia)

   

6beta-Hydroxy-hydromorphone

(14R)-4-methyl-12-oxa-4-azapentacyclo[9.6.1.0¹,¹³.0⁵,¹⁷.0⁷,¹⁸]octadeca-7(18),8,10-triene-10,14-diol

C17H21NO3 (287.1521356)


6beta-Hydroxy-hydromorphone is a metabolite of hydromorphone. Hydromorphone, a more common synonym for dihydromorphinone, commonly a hydrochloride (brand names Palladone, Dilaudid, and numerous others) is a very potent centrally acting analgesic drug of the opioid class. It is a derivative of morphine, to be specific, a hydrogenated ketone thereof and, therefore, a semi-synthetic drug. It is, in medical terms, an opioid analgesic and, in legal terms, a narcotic. (Wikipedia)

   

Dihydroisomorphine

(1S,5R,13R,14R,17R)-4-methyl-12-oxa-4-azapentacyclo[9.6.1.0^{1,13}.0^{5,17}.0^{7,18}]octadeca-7,9,11(18)-triene-10,14-diol

C17H21NO3 (287.1521356)


Dihydroisomorphine is a metabolite of hydromorphone. Hydromorphone, a more common synonym for dihydromorphinone, commonly a hydrochloride (brand names Palladone, Dilaudid, and numerous others) is a very potent centrally acting analgesic drug of the opioid class. It is a derivative of morphine, to be specific, a hydrogenated ketone thereof and, therefore, a semi-synthetic drug. It is, in medical terms, an opioid analgesic and, in legal terms, a narcotic. (Wikipedia)

   

Ritodrina

4-(1-hydroxy-2-{[2-(4-hydroxyphenyl)ethyl]amino}propyl)phenol

C17H21NO3 (287.1521356)


G - Genito urinary system and sex hormones > G02 - Other gynecologicals > G02C - Other gynecologicals > G02CA - Sympathomimetics, labour repressants D018373 - Peripheral Nervous System Agents > D001337 - Autonomic Agents > D013566 - Sympathomimetics D018377 - Neurotransmitter Agents > D018663 - Adrenergic Agents > D000322 - Adrenergic Agonists D012102 - Reproductive Control Agents > D015149 - Tocolytic Agents

   

Hydromorphine

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

C17H21NO3 (287.1521356)


D002491 - Central Nervous System Agents > D002492 - Central Nervous System Depressants > D009294 - Narcotics D002492 - Central Nervous System Depressants > D009294 - Narcotics > D053610 - Opiate Alkaloids D018373 - Peripheral Nervous System Agents > D018689 - Sensory System Agents D002491 - Central Nervous System Agents > D000700 - Analgesics

   

Epigalanthamin

9-methoxy-4-methyl-11-oxa-4-azatetracyclo[8.6.1.0¹,¹².0⁶,¹⁷]heptadeca-6,8,10(17),15-tetraen-14-ol

C17H21NO3 (287.1521356)


D018373 - Peripheral Nervous System Agents > D001337 - Autonomic Agents > D010277 - Parasympathomimetics D018377 - Neurotransmitter Agents > D018678 - Cholinergic Agents > D002800 - Cholinesterase Inhibitors D002491 - Central Nervous System Agents > D018697 - Nootropic Agents D004791 - Enzyme Inhibitors

   

Thesinine

(Hexahydro-1H-pyrrolizin-1-yl)methyl (2E)-3-(4-hydroxyphenyl)prop-2-enoic acid

C17H21NO3 (287.1521356)


Thesinine is a member of the class of compounds known as coumaric acid esters. Coumaric acid esters are aromatic compounds containing an ester derivative of coumaric acid. Thesinine is practically insoluble (in water) and a very weakly acidic compound (based on its pKa). Thesinine can be found in borage, which makes thesinine a potential biomarker for the consumption of this food product. Thesinine is a pyrrolizidine alkaloid first isolated from Thesium minkwitzianum from which it derives its name. It is also found in the flowers and seeds of borage .

   
   
   

O-Methylglycosolone

4,8-Dimethoxy-1-methyl-3-prenylquinolin-2-one

C17H21NO3 (287.1521356)


   
   

Latisodine

4-[2-[(3,4-dimethoxyphenyl)methylamino]ethyl]phenol

C17H21NO3 (287.1521356)


   

Pluviine

O-Methylnorpluviine

C17H21NO3 (287.1521356)


   
   

Malatyamine ethylester

Malatyamine ethylester

C17H21NO3 (287.1521356)


   
   
   
   
   
   
   

9,14,14b,15-tetrahydro-8H-pyrido[4,3:4,5]azepino[1,2:1,2]pyrido[3,4-b]indole|Naufolin|Naufoline

9,14,14b,15-tetrahydro-8H-pyrido[4,3:4,5]azepino[1,2:1,2]pyrido[3,4-b]indole|Naufolin|Naufoline

C19H17N3 (287.1422402)


   
   

5t-benzo[1,3]dioxol-5-yl-penta-2t,4-dienoic acid isopentylamide|5t-Benzo[1,3]dioxol-5-yl-penta-2t,4-diensaeure-isopentylamid|piperic acid isopentyl amide

5t-benzo[1,3]dioxol-5-yl-penta-2t,4-dienoic acid isopentylamide|5t-Benzo[1,3]dioxol-5-yl-penta-2t,4-diensaeure-isopentylamid|piperic acid isopentyl amide

C17H21NO3 (287.1521356)


   

l-Rotundin, l-Tetrahydropalmatine|Rotundin

l-Rotundin, l-Tetrahydropalmatine|Rotundin

C17H21NO3 (287.1521356)


   

3-O-methylepimacowine

3-O-methylepimacowine

C17H21NO3 (287.1521356)


   

bisdehydroneostemoninine

bisdehydroneostemoninine

C17H21NO3 (287.1521356)


   

7-[4-(dimethylamino)phenyl]-4,6-dimethyl-7-oxohepta-2,4-dienoic acid

7-[4-(dimethylamino)phenyl]-4,6-dimethyl-7-oxohepta-2,4-dienoic acid

C17H21NO3 (287.1521356)


   

3alpha-cynnamoyloxytropan-6beta-ol

3alpha-cynnamoyloxytropan-6beta-ol

C17H21NO3 (287.1521356)


   
   
   
   
   
   

4-(2-(3,4-Dimethoxybenzylamino)ethyl)phenol

4-(2-(3,4-Dimethoxybenzylamino)ethyl)phenol

C17H21NO3 (287.1521356)


   
   

Epigalantamine

(1S,12S,14S)-9-methoxy-4-methyl-11-oxa-4-azatetracyclo[8.6.1.0?,??.0?,??]heptadeca-6(17),7,9,15-tetraen-14-ol

C17H21NO3 (287.1521356)


Epigalantamine is a natural product found in Lycoris sanguinea, Lycoris radiata, and other organisms with data available.

   

etodolac

etodolac

C17H21NO3 (287.1521356)


M - Musculo-skeletal system > M01 - Antiinflammatory and antirheumatic products > M01A - Antiinflammatory and antirheumatic products, non-steroids > M01AB - Acetic acid derivatives and related substances D018501 - Antirheumatic Agents > D000894 - Anti-Inflammatory Agents, Non-Steroidal > D016861 - Cyclooxygenase Inhibitors D004791 - Enzyme Inhibitors > D016861 - Cyclooxygenase Inhibitors > D052246 - Cyclooxygenase 2 Inhibitors C78272 - Agent Affecting Nervous System > C241 - Analgesic Agent > C2198 - Nonnarcotic Analgesic D006133 - Growth Substances > D010937 - Plant Growth Regulators > D007210 - Indoleacetic Acids D018373 - Peripheral Nervous System Agents > D018689 - Sensory System Agents D002491 - Central Nervous System Agents > D000700 - Analgesics D000893 - Anti-Inflammatory Agents CONFIDENCE standard compound; EAWAG_UCHEM_ID 3308

   

Galantamine

(-)Galanthamine

C17H21NO3 (287.1521356)


D018373 - Peripheral Nervous System Agents > D001337 - Autonomic Agents > D010277 - Parasympathomimetics D018377 - Neurotransmitter Agents > D018678 - Cholinergic Agents > D002800 - Cholinesterase Inhibitors N - Nervous system > N06 - Psychoanaleptics > N06D - Anti-dementia drugs > N06DA - Anticholinesterases Origin: Plant; SubCategory_DNP: Isoquinoline alkaloids, Amaryllidaceae alkaloids D002491 - Central Nervous System Agents > D018697 - Nootropic Agents C471 - Enzyme Inhibitor > C47792 - Acetylcholinesterase Inhibitor D004791 - Enzyme Inhibitors Origin: Plant, Benzazepines CONFIDENCE Reference Standard (Level 1); INTERNAL_ID 27 relative retention time with respect to 9-anthracene Carboxylic Acid is 0.263 relative retention time with respect to 9-anthracene Carboxylic Acid is 0.257 Galanthamine is a potent acetylcholinesterase (AChE) inhibitor with an IC50 of 500 nM. Galanthamine is a potent acetylcholinesterase (AChE) inhibitor with an IC50 of 500 nM.

   
   

(E)-5-(1,3-benzodioxol-5-yl)-1-piperidin-1-ylpent-2-en-1-one

NCGC00180838-02!(E)-5-(1,3-benzodioxol-5-yl)-1-piperidin-1-ylpent-2-en-1-one

C17H21NO3 (287.1521356)


   

C17H21NO3_3a-(3,4-Dimethoxyphenyl)-1-methyl-1,2,3,3a,4,5-hexahydro-6H-indol-6-one

NCGC00385278-01_C17H21NO3_3a-(3,4-Dimethoxyphenyl)-1-methyl-1,2,3,3a,4,5-hexahydro-6H-indol-6-one

C17H21NO3 (287.1521356)


   
   

Piperanine

(2E)-5-(2H-1,3-benzodioxol-5-yl)-1-(piperidin-1-yl)pent-2-en-1-one

C17H21NO3 (287.1521356)


   

3a-(3,4-dimethoxyphenyl)-1-methyl-2,3,4,5-tetrahydroindol-6-one

3a-(3,4-dimethoxyphenyl)-1-methyl-2,3,4,5-tetrahydroindol-6-one

C17H21NO3 (287.1521356)


   

4-O,N-dimethylnorbelladine

4-O,N-dimethylnorbelladine

C17H21NO3 (287.1521356)


   
   

C.I. Basic Red 9

C.I. Basic Red 9

C19H17N3 (287.1422402)


D004396 - Coloring Agents > D012394 - Rosaniline Dyes D005404 - Fixatives CONFIDENCE standard compound; INTERNAL_ID 229; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 6850; ORIGINAL_PRECURSOR_SCAN_NO 6849 CONFIDENCE standard compound; INTERNAL_ID 229; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 6885; ORIGINAL_PRECURSOR_SCAN_NO 6883 CONFIDENCE standard compound; INTERNAL_ID 229; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 6893; ORIGINAL_PRECURSOR_SCAN_NO 6892 CONFIDENCE standard compound; INTERNAL_ID 229; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 6896; ORIGINAL_PRECURSOR_SCAN_NO 6895 CONFIDENCE standard compound; INTERNAL_ID 229; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 6827; ORIGINAL_PRECURSOR_SCAN_NO 6826 CONFIDENCE standard compound; INTERNAL_ID 229; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 6868; ORIGINAL_PRECURSOR_SCAN_NO 6867

   
   

GALANTHAMINE_77.1\\%

GALANTHAMINE_77.1\\%

C17H21NO3 (287.1521356)


   
   

GALANTHAMINE_53.1\\%

GALANTHAMINE_53.1\\%

C17H21NO3 (287.1521356)


   
   
   

Nordihydrocodeine

(9-methoxy-3-trimethylsilyl-2,4,4a,5,6,7,7a,13-octahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinoline-7-yl)oxy-trimethylsilane

C17H21NO3 (287.1521356)


D002492 - Central Nervous System Depressants > D009294 - Narcotics > D053610 - Opiate Alkaloids

   
   

Arg-hpro

5-carbamimidamido-2-[(4-hydroxypyrrolidin-2-yl)formamido]pentanoic acid

C11H21N5O4 (287.15934660000005)


   

Hpro-arg

1-(2-amino-5-carbamimidamidopentanoyl)-4-hydroxypyrrolidine-2-carboxylic acid

C11H21N5O4 (287.15934660000005)


   

Feruperine

(2E,4Z)-5-(4-hydroxy-3-methoxyphenyl)-1-(piperidin-1-yl)penta-2,4-dien-1-one

C17H21NO3 (287.1521356)


   

4-tert-butyl-2-[3-(trifluoromethyl)phenyl]morpholine

4-tert-butyl-2-[3-(trifluoromethyl)phenyl]morpholine

C15H20F3NO (287.14969060000004)


   

2-(2-METHYL-2H-TETRAZOL-5-YL)-5-(4,4,5,5-TETRAMETHYL-1,3, - 2DIOXABOROLAN-2-YL)PYRIDINE

2-(2-METHYL-2H-TETRAZOL-5-YL)-5-(4,4,5,5-TETRAMETHYL-1,3, - 2DIOXABOROLAN-2-YL)PYRIDINE

C13H18BN5O2 (287.1553478)


   

1,2,3-Triphenylguanidine

1,2,3-Triphenylguanidine

C19H17N3 (287.1422402)


   

2,6-dimethoxy-4-[(1-phenylethylamino)methyl]phenol

2,6-dimethoxy-4-[(1-phenylethylamino)methyl]phenol

C17H21NO3 (287.1521356)


   

tert-butyl 7-ethoxynaphthalen-1-ylcarbamate

tert-butyl 7-ethoxynaphthalen-1-ylcarbamate

C17H21NO3 (287.1521356)


   

2-(Diphenylmethyl)piperidine hydrochloride (1:1)

2-(Diphenylmethyl)piperidine hydrochloride (1:1)

C18H22ClN (287.14406820000005)


   

BENZYL-(3,4,5-TRIMETHOXYBENZYL)AMINE

BENZYL-(3,4,5-TRIMETHOXYBENZYL)AMINE

C17H21NO3 (287.1521356)


   

2-(2-quinolin-6-yl-1H-indol-3-yl)ethanamine

2-(2-quinolin-6-yl-1H-indol-3-yl)ethanamine

C19H17N3 (287.1422402)


   

(3S,4R)-4-Acetoxy-3-[(R)-1-(tert-butyldimethylsilyloxy)ethyl]azetidin-2-one

(3S,4R)-4-Acetoxy-3-[(R)-1-(tert-butyldimethylsilyloxy)ethyl]azetidin-2-one

C13H25NO4Si (287.155277)


   

3-Amino-1-(2-ethoxyphenoxy)-1-phenyl-2-propanol

3-Amino-1-(2-ethoxyphenoxy)-1-phenyl-2-propanol

C17H21NO3 (287.1521356)


   

1-[BIS-(4-FLUOROPHENYL)-METHYL]-PIPERIDINE

1-[BIS-(4-FLUOROPHENYL)-METHYL]-PIPERIDINE

C18H19F2N (287.1485478)


   

4-((4-ethylpiperazin-1-yl)Methyl)-3-(trifluoromethyl)aniline

4-((4-ethylpiperazin-1-yl)Methyl)-3-(trifluoromethyl)aniline

C14H20F3N3 (287.16092360000005)


   

N-(3-METHYLPHENYL)-N-[4-(PHENYLAZO)PHENYL]AMINE

N-(3-METHYLPHENYL)-N-[4-(PHENYLAZO)PHENYL]AMINE

C19H17N3 (287.1422402)


   

N-formylpropranolol

N-formylpropranolol

C17H21NO3 (287.1521356)


   

1,1-DIMETHYLETHYL [2-HYDROXY-2-(1-NAPHTHALENYL)ETHYL]CARBAMATE

1,1-DIMETHYLETHYL [2-HYDROXY-2-(1-NAPHTHALENYL)ETHYL]CARBAMATE

C17H21NO3 (287.1521356)


   

1-cyclopropyl-6-fluoro-7-piperazin-1-ylquinolin-4-one

1-cyclopropyl-6-fluoro-7-piperazin-1-ylquinolin-4-one

C16H18FN3O (287.14338300000003)


   
   
   

(R)-trichostatic acid

(R)-trichostatic acid

C17H21NO3 (287.1521356)


   
   

(S)-trichostatic acid

(S)-trichostatic acid

C17H21NO3 (287.1521356)


   

(1S)-9-methoxy-4-methyl-11-oxa-4-azatetracyclo[8.6.1.01,12.06,17]heptadeca-6(17),7,9,15-tetraen-14-ol

(1S)-9-methoxy-4-methyl-11-oxa-4-azatetracyclo[8.6.1.01,12.06,17]heptadeca-6(17),7,9,15-tetraen-14-ol

C17H21NO3 (287.1521356)


   

3-oxononanoyl-N-acetylcysteamine

3-oxononanoyl-N-acetylcysteamine

C14H25NO3S (287.155506)


   

[(1S,5R)-8-methyl-8-azabicyclo[3.2.1]octan-3-yl] 3-oxo-2-phenylpropanoate

[(1S,5R)-8-methyl-8-azabicyclo[3.2.1]octan-3-yl] 3-oxo-2-phenylpropanoate

C17H21NO3 (287.1521356)


   

Nordihydroisomorphine

Nordihydroisomorphine

C17H21NO3 (287.1521356)


   
   

2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-ylmethyl (E)-3-(4-hydroxyphenyl)prop-2-enoate

2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-ylmethyl (E)-3-(4-hydroxyphenyl)prop-2-enoate

C17H21NO3 (287.1521356)


   

Yutopar

4-[2-[[(1S,2R)-1-hydroxy-1-(4-hydroxyphenyl)propan-2-yl]amino]ethyl]phenol

C17H21NO3 (287.1521356)


G - Genito urinary system and sex hormones > G02 - Other gynecologicals > G02C - Other gynecologicals > G02CA - Sympathomimetics, labour repressants D018373 - Peripheral Nervous System Agents > D001337 - Autonomic Agents > D013566 - Sympathomimetics C78272 - Agent Affecting Nervous System > C29747 - Adrenergic Agent > C87053 - Adrenergic Agonist D018377 - Neurotransmitter Agents > D018663 - Adrenergic Agents > D000322 - Adrenergic Agonists D012102 - Reproductive Control Agents > D015149 - Tocolytic Agents

   

1,4,8-Trimethyl-12-quinolino[2,3-b]quinolinamine

1,4,8-Trimethyl-12-quinolino[2,3-b]quinolinamine

C19H17N3 (287.1422402)


   

4-[(Bicyclo[4.1.0]heptane-7-carbonyl)-amino]-benzoic acid ethyl ester

4-[(Bicyclo[4.1.0]heptane-7-carbonyl)-amino]-benzoic acid ethyl ester

C17H21NO3 (287.1521356)


   

(2E)-3-azepan-1-yl-2-[(3-fluorophenyl)hydrazono]-3-iminopropanenitrile

(2E)-3-azepan-1-yl-2-[(3-fluorophenyl)hydrazono]-3-iminopropanenitrile

C15H18FN5 (287.15461600000003)


   

N-Acetyl-ala-ala-ala-methylester

N-Acetyl-ala-ala-ala-methylester

C12H21N3O5 (287.1481136)


   

(2S,3R)-2-[[(2S)-1-[(2S)-2-aminopropanoyl]pyrrolidine-2-carbonyl]amino]-3-hydroxybutanoic acid

(2S,3R)-2-[[(2S)-1-[(2S)-2-aminopropanoyl]pyrrolidine-2-carbonyl]amino]-3-hydroxybutanoic acid

C12H21N3O5 (287.1481136)


   

1-[(3-hydroxy-4-methoxyphenyl)methyl]-2,3,4,7,8,8a-hexahydro-1H-isoquinolin-6-one

1-[(3-hydroxy-4-methoxyphenyl)methyl]-2,3,4,7,8,8a-hexahydro-1H-isoquinolin-6-one

C17H21NO3 (287.1521356)


   

3-[5-(4-Methoxyphenyl)-1-propyl-2-pyrrolyl]propanoic acid

3-[5-(4-Methoxyphenyl)-1-propyl-2-pyrrolyl]propanoic acid

C17H21NO3 (287.1521356)


   

N-[(2S)-3-hydroxy-2-(7-methoxy-1-naphthyl)propyl]propionamide

N-[(2S)-3-hydroxy-2-(7-methoxy-1-naphthyl)propyl]propionamide

C17H21NO3 (287.1521356)


   

N-[(2R)-3-hydroxy-2-(7-methoxy-1-naphthyl)propyl]propionamide

N-[(2R)-3-hydroxy-2-(7-methoxy-1-naphthyl)propyl]propionamide

C17H21NO3 (287.1521356)


   

N-[3-hydroxy-2-(7-methoxy-1-naphthyl)propyl]propionamide

N-[3-hydroxy-2-(7-methoxy-1-naphthyl)propyl]propionamide

C17H21NO3 (287.1521356)


   

1-(2-Ethyl-6-methylphenyl)-3-[(1-methyl-2-pyrrolyl)methyl]thiourea

1-(2-Ethyl-6-methylphenyl)-3-[(1-methyl-2-pyrrolyl)methyl]thiourea

C16H21N3S (287.1456106)


   

5,7-dimethyl-3-(4-methylphenyl)-3H-pyrido[4,3,2-de]quinazoline

5,7-dimethyl-3-(4-methylphenyl)-3H-pyrido[4,3,2-de]quinazoline

C19H17N3 (287.1422402)


   

(4aR,7aR)-9-methoxy-3-methyl-2,4,4a,5,6,7a-hexahydro-1H-benzofuro[3,2-e]isoquinolin-7-one

(4aR,7aR)-9-methoxy-3-methyl-2,4,4a,5,6,7a-hexahydro-1H-benzofuro[3,2-e]isoquinolin-7-one

C17H21NO3 (287.1521356)


   
   
   
   
   

(3R,8Z,11R)-11-methyl-3-phenyl-1-oxa-5-azacyclododec-8-ene-4,12-dione

(3R,8Z,11R)-11-methyl-3-phenyl-1-oxa-5-azacyclododec-8-ene-4,12-dione

C17H21NO3 (287.1521356)


   

ethyl 2-[(1S)-8-ethyl-1,3,4,9-tetrahydropyrano[3,4-b]indol-1-yl]acetate

ethyl 2-[(1S)-8-ethyl-1,3,4,9-tetrahydropyrano[3,4-b]indol-1-yl]acetate

C17H21NO3 (287.1521356)


   

(4S,9Z,12R)-12-methyl-4-phenyl-1-oxa-5-azacyclododec-9-ene-2,6-dione

(4S,9Z,12R)-12-methyl-4-phenyl-1-oxa-5-azacyclododec-9-ene-2,6-dione

C17H21NO3 (287.1521356)


   
   
   

(2E)-8-[(3,6-dideoxy-alpha-L-arabino-hexopyranosyl)oxy]oct-2-enoate

(2E)-8-[(3,6-dideoxy-alpha-L-arabino-hexopyranosyl)oxy]oct-2-enoate

C14H23O6- (287.1494558)


   

2-(1,8-diethyl-4,8-dihydro-3H-pyrano[3,4-b]indol-1-yl)acetic acid

2-(1,8-diethyl-4,8-dihydro-3H-pyrano[3,4-b]indol-1-yl)acetic acid

C17H21NO3 (287.1521356)


   

2-[(4-Methoxyphenyl)methyliminomethyl]-5,5-dimethylcyclohexane-1,3-dione

2-[(4-Methoxyphenyl)methyliminomethyl]-5,5-dimethylcyclohexane-1,3-dione

C17H21NO3 (287.1521356)


   

(E,7R)-7-[(2R,3R,5R,6S)-3,5-dihydroxy-6-methyloxan-2-yl]oxyoct-2-enoate

(E,7R)-7-[(2R,3R,5R,6S)-3,5-dihydroxy-6-methyloxan-2-yl]oxyoct-2-enoate

C14H23O6- (287.1494558)


   

[4-Methyl-1-(1-methylindol-3-yl)-3-oxopentan-2-yl] acetate

[4-Methyl-1-(1-methylindol-3-yl)-3-oxopentan-2-yl] acetate

C17H21NO3 (287.1521356)


   

[(2S,4S)-1-(1H-indol-3-yl)-4-methyl-3-oxohexan-2-yl] acetate

[(2S,4S)-1-(1H-indol-3-yl)-4-methyl-3-oxohexan-2-yl] acetate

C17H21NO3 (287.1521356)


   

[(2S)-1-(1H-indol-3-yl)-4-methyl-3-oxopentan-2-yl] propanoate

[(2S)-1-(1H-indol-3-yl)-4-methyl-3-oxopentan-2-yl] propanoate

C17H21NO3 (287.1521356)


   

N-Acetyl-glycyl-valyl-glycine methylester

N-Acetyl-glycyl-valyl-glycine methylester

C12H21N3O5 (287.1481136)


   

N-Acetyl-alanyl-alanyl-alanine methyl ester

N-Acetyl-alanyl-alanyl-alanine methyl ester

C12H21N3O5 (287.1481136)


   

ritodrine

ritodrine

C17H21NO3 (287.1521356)


G - Genito urinary system and sex hormones > G02 - Other gynecologicals > G02C - Other gynecologicals > G02CA - Sympathomimetics, labour repressants D018373 - Peripheral Nervous System Agents > D001337 - Autonomic Agents > D013566 - Sympathomimetics D018377 - Neurotransmitter Agents > D018663 - Adrenergic Agents > D000322 - Adrenergic Agonists D012102 - Reproductive Control Agents > D015149 - Tocolytic Agents

   

Dihydromorphine

Dihydromorphine

C17H21NO3 (287.1521356)


D002491 - Central Nervous System Agents > D002492 - Central Nervous System Depressants > D009294 - Narcotics D002492 - Central Nervous System Depressants > D009294 - Narcotics > D053610 - Opiate Alkaloids D018373 - Peripheral Nervous System Agents > D018689 - Sensory System Agents D002491 - Central Nervous System Agents > D000700 - Analgesics

   

Epigalanthamin

Epigalanthamin

C17H21NO3 (287.1521356)


D018373 - Peripheral Nervous System Agents > D001337 - Autonomic Agents > D010277 - Parasympathomimetics D018377 - Neurotransmitter Agents > D018678 - Cholinergic Agents > D002800 - Cholinesterase Inhibitors D002491 - Central Nervous System Agents > D018697 - Nootropic Agents D004791 - Enzyme Inhibitors

   

Ritodrina

Ritodrine hydrochloride

C17H21NO3 (287.1521356)


G - Genito urinary system and sex hormones > G02 - Other gynecologicals > G02C - Other gynecologicals > G02CA - Sympathomimetics, labour repressants D018373 - Peripheral Nervous System Agents > D001337 - Autonomic Agents > D013566 - Sympathomimetics D018377 - Neurotransmitter Agents > D018663 - Adrenergic Agents > D000322 - Adrenergic Agonists D012102 - Reproductive Control Agents > D015149 - Tocolytic Agents

   
   

6alpha-Hydroxy-hydromorphone

6alpha-Hydroxy-hydromorphone

C17H21NO3 (287.1521356)


   
   

ascr#13(1-)

ascr#13(1-)

C14H23O6 (287.1494558)


Conjugate base of ascr#13

   
   

oscr#13(1-)

oscr#13(1-)

C14H23O6 (287.1494558)


A hydroxy fatty acid ascaroside anion that is the conjugate base of oscr#13, obtained by deprotonation of the carboxy group; major species at pH 7.3.

   
   

1-(1h-indol-3-yl)-4-methyl-3-oxohexan-2-yl acetate

1-(1h-indol-3-yl)-4-methyl-3-oxohexan-2-yl acetate

C17H21NO3 (287.1521356)


   

5-(4-hydroxy-3-methoxyphenyl)-1-(piperidin-1-yl)penta-2,4-dien-1-one

5-(4-hydroxy-3-methoxyphenyl)-1-(piperidin-1-yl)penta-2,4-dien-1-one

C17H21NO3 (287.1521356)


   

(1r,5r)-6-hydroxy-8-methyl-8-azabicyclo[3.2.1]octan-3-yl 3-phenylprop-2-enoate

(1r,5r)-6-hydroxy-8-methyl-8-azabicyclo[3.2.1]octan-3-yl 3-phenylprop-2-enoate

C17H21NO3 (287.1521356)


   

6-hydroxy-8-methyl-8-azabicyclo[3.2.1]octan-3-yl 2-phenylprop-2-enoate

6-hydroxy-8-methyl-8-azabicyclo[3.2.1]octan-3-yl 2-phenylprop-2-enoate

C17H21NO3 (287.1521356)


   

(9bs,11r,12r)-11-methoxy-1h,2h,4h,5h,10h,11h,12h-indolo[7a,1-a]isoquinoline-8,12-diol

(9bs,11r,12r)-11-methoxy-1h,2h,4h,5h,10h,11h,12h-indolo[7a,1-a]isoquinoline-8,12-diol

C17H21NO3 (287.1521356)