Exact Mass: 249.22048619999998

Exact Mass Matches: 249.22048619999998

Found 183 metabolites which its exact mass value is equals to given mass value 249.22048619999998, within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error 0.01 dalton.

   
   

Alprenolol

1-[2-(prop-2-en-1-yl)phenoxy]-3-[(propan-2-yl)amino]propan-2-ol

C15H23NO2 (249.1728698)


Alprenolol is only found in individuals that have used or taken this drug. It is one of the adrenergic beta-antagonists used as an antihypertensive, anti-anginal, and anti-arrhythmic agent. [PubChem]Alprenolol non-selectively blocks beta-1 adrenergic receptors mainly in the heart, inhibiting the effects of epinephrine and norepinephrine resulting in a decrease in heart rate and blood pressure. Also, with a more minor effect, by binding beta-2 receptors in the juxtaglomerular apparatus, alprenolol inhibits the production of renin, thereby inhibiting angiotensin II and aldosterone production and therefore inhibits the vasoconstriction and water retention due to angiotensin II and aldosterone, respectively. C - Cardiovascular system > C07 - Beta blocking agents > C07A - Beta blocking agents > C07AA - Beta blocking agents, non-selective C78272 - Agent Affecting Nervous System > C29747 - Adrenergic Agent > C72900 - Adrenergic Antagonist D018373 - Peripheral Nervous System Agents > D001337 - Autonomic Agents > D013565 - Sympatholytics D018377 - Neurotransmitter Agents > D018663 - Adrenergic Agents > D018674 - Adrenergic Antagonists D002317 - Cardiovascular Agents > D000959 - Antihypertensive Agents D002317 - Cardiovascular Agents > D000889 - Anti-Arrhythmia Agents

   

O-Desmethyltramadol

3-[(1R,2R)-2-[(dimethylamino)methyl]-1-hydroxycyclohexyl]phenol

C15H23NO2 (249.1728698)


O-Desmethyltramadol is a metabolite of tramadol. O-Desmethyltramadol (O-DSMT) is an opioid analgesic and the main active metabolite of tramadol. (+)-O-Desmethyltramadol is the most important metabolite of tramadol produced in the liver after tramadol is consumed. This metabolite is considerably more potent as a μ-opioid agonist than the parent compound (Wikipedia). 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 > C241 - Analgesic Agent D002491 - Central Nervous System Agents > D000700 - Analgesics

   

N-Desmethyltramadol

(1R,2R)-1-(3-methoxyphenyl)-2-[(methylamino)methyl]cyclohexan-1-ol

C15H23NO2 (249.1728698)


N-Desmethyltramadol is a metabolite of tramadol. Tramadol hydrochloride (trademarked as Conzip, Ryzolt, Ultracet, Ultram in the USA; Ralivia and Zytram XL in Canada) is a centrally-acting synthetic analgesic used to treat moderate to moderately-severe pain. The drug has a wide range of applications, including treatment of rheumatoid arthritis, restless legs syndrome, and fibromyalgia. It was launched and marketed as Tramal by the German pharmaceutical company Grnenthal GmbH in 1977 (Wikipedia).

   

N,O-Didesmethylvenlafaxine

4-[1-(1-Hydroxycyclohexyl)-2-(methylamino)ethyl]phenol

C15H23NO2 (249.1728698)


N,O-Didesmethylvenlafaxine is a metabolite of venlafaxine (brand name: Effexor or Efexor). Venlafaxine is a bicyclic antidepressant and is usually categorized as a serotonin-norepinephrine reuptake inhibitor (SNRI), but it has been referred to as a serotonin-norepinephrine-dopamine reuptake inhibitor. It works by blocking the transporter reuptake proteins for key neurotransmitters affecting mood, thereby leaving more active neurotransmitters in the synapse.

   

2,4-Dodecadienoic acid pyrrolidide

(2E,4E)-1-(pyrrolidin-1-yl)dodeca-2,4-dien-1-one

C16H27NO (249.20925319999998)


2,4-Dodecadienoic acid pyrrolidide is found in herbs and spices. 2,4-Dodecadienoic acid pyrrolidide is a constituent of pepper (Piper nigrum) (Piperaceae). Constituent of pepper (Piper nigrum) (Piperaceae). 2,4-Dodecadienoic acid pyrrolidide is found in herbs and spices and pepper (spice).

   

Ciramadol

3-[(dimethylamino)(2-hydroxycyclohexyl)methyl]phenol

C15H23NO2 (249.1728698)


   

N-Demethyltramadol

1-(3-methoxyphenyl)-2-[(methylamino)methyl]cyclohexan-1-ol

C15H23NO2 (249.1728698)


   

O-Demethyltramadol

3-{2-[(dimethylamino)methyl]-1-hydroxycyclohexyl}phenol

C15H23NO2 (249.1728698)


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

   

(1alpha,2beta,4aalpha,8aalpha)-N-[Decahydro-4a-methyl-8-methylene-2-(1-methylethyl)-1-naphthalenyl]-formamide

(1alpha,2beta,4aalpha,8aalpha)-N-[Decahydro-4a-methyl-8-methylene-2-(1-methylethyl)-1-naphthalenyl]-formamide

C16H27NO (249.20925319999998)


   

1-(1,6-Dioxo-2E,4E-decadienyl)piperidine

1-(1,6-Dioxo-2E,4E-decadienyl)piperidine

C15H23NO2 (249.1728698)


   

Dihydrolycopodine

5-Deoxo-5beta-hydroxylycopodine

C16H27NO (249.20925319999998)


   

Axamide 1

[1R-[1alpha(S*),3aalpha,7aalpha]]-N-[2-Methyl-1-(octahydro-3a-methyl-7-methylene-1H-inden-1-yl)propyl]formamide

C16H27NO (249.20925319999998)


   

5-pentyl-3-methoxy-N-butylaniline

5-pentyl-3-methoxy-N-butylaniline

C16H27NO (249.20925319999998)


   

N,N-Didesmethylvenlafaxine

1-(4-Methoxyphenyl)-2-aminoethyl cyclohexanol hydrochloride

C15H23NO2 (249.1728698)


A monomethoxybenzene that is the N,N-didesmethyl derivative of venlafaxine. CONFIDENCE standard compound; EAWAG_UCHEM_ID 2658

   

O-Desmethyltramadol

O-Desmethyltramadol

C15H23NO2 (249.1728698)


CONFIDENCE standard compound; INTERNAL_ID 2269

   

N-(3,7,11-trimethyldodeca-2,6,10-trienyl)formamide

N-(3,7,11-trimethyldodeca-2,6,10-trienyl)formamide

C16H27NO (249.20925319999998)


   

(1S,4S,7S,8R,11R,12R,13S)-13-isopropyl-12-methyl-10-oxa-2-azatetracyclo<5.4.1.1.8,11.04,12>tridecan-9-one|14-Nor-dendroban-12-on|14-nor-dendroban-12-one|mubironine B|Nordendrobin

(1S,4S,7S,8R,11R,12R,13S)-13-isopropyl-12-methyl-10-oxa-2-azatetracyclo<5.4.1.1.8,11.04,12>tridecan-9-one|14-Nor-dendroban-12-on|14-nor-dendroban-12-one|mubironine B|Nordendrobin

C15H23NO2 (249.1728698)


   
   

N-(2-methyl-3-oxodecanoyl)pyrrole

N-(2-methyl-3-oxodecanoyl)pyrrole

C15H23NO2 (249.1728698)


   

2-(6-Heptenyl)-(6-(4-pentenyl)piperidine

2-(6-Heptenyl)-(6-(4-pentenyl)piperidine

C17H31N (249.24563659999998)


   

(2R,5R,10S)-2-formamido-6-axene

(2R,5R,10S)-2-formamido-6-axene

C16H27NO (249.20925319999998)


   
   

aldotripiperideine|alpha-Aldotripiperidein|Hexadecahydro-dipyrido[2,1-f;2,3-h][1,6]naphthyridin|hexadecahydro-dipyrido[2,1-f;2,3-h][1,6]naphthyridine

aldotripiperideine|alpha-Aldotripiperidein|Hexadecahydro-dipyrido[2,1-f;2,3-h][1,6]naphthyridin|hexadecahydro-dipyrido[2,1-f;2,3-h][1,6]naphthyridine

C15H27N3 (249.22048619999998)


   

(-)-Isocastoramin|(-)-isocastoramine|(9aS)-6t-furan-3-yl-3t,9c-dimethyl-(9ar)-octahydro-quinolizin-2t-ol|Isocastoramine

(-)-Isocastoramin|(-)-isocastoramine|(9aS)-6t-furan-3-yl-3t,9c-dimethyl-(9ar)-octahydro-quinolizin-2t-ol|Isocastoramine

C15H23NO2 (249.1728698)


   

11-formamido-7beta-H-eudesm-5-ene|11-formamido-7betaH-eudesm-5-ene

11-formamido-7beta-H-eudesm-5-ene|11-formamido-7betaH-eudesm-5-ene

C16H27NO (249.20925319999998)


   

2-(hept-5-enyl)-3-methyl-4-oxo-6,7,8,8a-tetrahydro-4h-pyrrolo[2,1-b]-1,3-oxazine

2-(hept-5-enyl)-3-methyl-4-oxo-6,7,8,8a-tetrahydro-4h-pyrrolo[2,1-b]-1,3-oxazine

C15H23NO2 (249.1728698)


   
   

rel-7-formamido-7,8-dihydro-alpha-bisabolane|rel-N-{(2S)-6-methyl-2-[(1R)-4-methylcyclohex-3-en-1-yl]-hept-5-en-2-yl}formamide

rel-7-formamido-7,8-dihydro-alpha-bisabolane|rel-N-{(2S)-6-methyl-2-[(1R)-4-methylcyclohex-3-en-1-yl]-hept-5-en-2-yl}formamide

C16H27NO (249.20925319999998)


   
   

clavolonine|Dihydrodesoxyclavolonin

clavolonine|Dihydrodesoxyclavolonin

C16H27NO (249.20925319999998)


   

(3S,5R,6R,9R)-3-formamido-1(10)-cadinene

(3S,5R,6R,9R)-3-formamido-1(10)-cadinene

C16H27NO (249.20925319999998)


   

3-formamidobisabolane-8,10-diene

3-formamidobisabolane-8,10-diene

C16H27NO (249.20925319999998)


   

4-(6-furan-3-yl-3-methyl-piperidin-2-yl)-2-methyl-but-2-en-1-ol|Nuphamin|Nuphamine

4-(6-furan-3-yl-3-methyl-piperidin-2-yl)-2-methyl-but-2-en-1-ol|Nuphamin|Nuphamine

C15H23NO2 (249.1728698)


   
   

N-(2-Isopropyl-3a,5-dimethyl-1,4-methanohydrindane-5-yl)formamide

N-(2-Isopropyl-3a,5-dimethyl-1,4-methanohydrindane-5-yl)formamide

C16H27NO (249.20925319999998)


   
   
   

rel-(4R,5R,7S,10R)-4-formamidoeudesm-11-ene

rel-(4R,5R,7S,10R)-4-formamidoeudesm-11-ene

C16H27NO (249.20925319999998)


   
   
   

N-(2-methyl-3-oxodec-8-enoyl)-2-pyrroline

N-(2-methyl-3-oxodec-8-enoyl)-2-pyrroline

C15H23NO2 (249.1728698)


   

(2E,4E)-2,4-Decadiensaeure-(4-hydroxy-2,3-didehydropiperidid)|(2E,4E)-2,4-Decadiensaeure-<4-hydroxy-2,3-didehydropiperidid>

(2E,4E)-2,4-Decadiensaeure-(4-hydroxy-2,3-didehydropiperidid)|(2E,4E)-2,4-Decadiensaeure-<4-hydroxy-2,3-didehydropiperidid>

C15H23NO2 (249.1728698)


   
   

(4R*,5R*,10R*)-4-formamidoeudesm-7-ene

(4R*,5R*,10R*)-4-formamidoeudesm-7-ene

C16H27NO (249.20925319999998)


   

N-Butyl-3-methoxy-5-pentylaniline

N-Butyl-3-methoxy-5-pentylaniline

C16H27NO (249.20925319999998)


   

N,N-Didesvenlafaxine

1-(4-Methoxyphenyl)-2-aminoethyl cyclohexanol hydrochloride

C15H23NO2 (249.1728698)


CONFIDENCE standard compound; INTERNAL_ID 2016

   

N,O-Didesvenlafaxine

N,O-Didesmethylvenlafaxine

C15H23NO2 (249.1728698)


CONFIDENCE standard compound; INTERNAL_ID 2017

   

N,O-Didesmethylvenlafaxine

N,O-Didesmethylvenlafaxine

C15H23NO2 (249.1728698)


A secondary amino compound that is N-methylethanamine substituted by a 1-hydroxycyclohexyl and a 4-hydroxyphenyl group at position 1. It is a metabolite of the drug venlafaxine. CONFIDENCE standard compound; EAWAG_UCHEM_ID 2657

   

Tramadol

N-Desmethyltramadol

C15H23NO2 (249.1728698)


CONFIDENCE standard compound; EAWAG_UCHEM_ID 3565

   

5-butyl-4-hydroxy-3-methyl-6-(3-methylbut-2-enyl)-1H-pyridin-2-one

NCGC00380352-01!5-butyl-4-hydroxy-3-methyl-6-(3-methylbut-2-enyl)-1H-pyridin-2-one

C15H23NO2 (249.1728698)


   

NVE_250.1804_10.8

N,O-Didesmethylvenlafaxine

C15H23NO2 (249.1728698)


CONFIDENCE Transformation product with Reference Standard (Level 1); INTERNAL_ID 1201

   

4-Aminoantipyrine

(+)-(1R,2R)-O-DESMETHYL TRAMADOL HCL

C15H23NO2 (249.1728698)


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 > C241 - Analgesic Agent D002491 - Central Nervous System Agents > D000700 - Analgesics CONFIDENCE standard compound; INTERNAL_ID 2270

   

O-Desmethyl tramadol

(+)-(1R,2R)-O-DESMETHYL TRAMADOL HCL

C15H23NO2 (249.1728698)


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 > C241 - Analgesic Agent D002491 - Central Nervous System Agents > D000700 - Analgesics CONFIDENCE standard compound; INTERNAL_ID 2287

   

alprenolol

alprenolol

C15H23NO2 (249.1728698)


C - Cardiovascular system > C07 - Beta blocking agents > C07A - Beta blocking agents > C07AA - Beta blocking agents, non-selective C78272 - Agent Affecting Nervous System > C29747 - Adrenergic Agent > C72900 - Adrenergic Antagonist D018373 - Peripheral Nervous System Agents > D001337 - Autonomic Agents > D013565 - Sympatholytics D018377 - Neurotransmitter Agents > D018663 - Adrenergic Agents > D018674 - Adrenergic Antagonists D002317 - Cardiovascular Agents > D000959 - Antihypertensive Agents D002317 - Cardiovascular Agents > D000889 - Anti-Arrhythmia Agents

   

(2S,5R)-5-(pent-4-en-1-yl)-2-propyldecahydroquinoline

(2S,5R)-5-(pent-4-en-1-yl)-2-propyldecahydroquinoline

C17H31N (249.24563659999998)


   

(2S,5S)-5-(pent-4-en-1-yl)-2-propyldecahydroquinoline

(2S,5S)-5-(pent-4-en-1-yl)-2-propyldecahydroquinoline

C17H31N (249.24563659999998)


   

(2S,5S)-2-(pent-4-en-1-yl)-5-propyldecahydroquinoline

(2S,5S)-2-(pent-4-en-1-yl)-5-propyldecahydroquinoline

C17H31N (249.24563659999998)


   

(3S,5R)-3-butyl-5-(pent-4-en-1-yl)octahydroindolizine

(3S,5R)-3-butyl-5-(pent-4-en-1-yl)octahydroindolizine

C17H31N (249.24563659999998)


   

8-(but-3-en-1-yl)-5-pentyloctahydroindolizine

8-(but-3-en-1-yl)-5-pentyloctahydroindolizine

C17H31N (249.24563659999998)


   

8-butyl-5-pentyl-1,2,3,5,8,8a-hexahydroindolizine

8-butyl-5-pentyl-1,2,3,5,8,8a-hexahydroindolizine

C17H31N (249.24563659999998)


   

(5S,6R,8R)-8-ethyl-5-((Z)-hex-3-en-3-yl)-6-methyloctahydroindolizine

(5S,6R,8R)-8-ethyl-5-((Z)-hex-3-en-3-yl)-6-methyloctahydroindolizine

C17H31N (249.24563659999998)


   

(2S,3S,7S,10S)-3,7,10-trimethyldodecahydrocyclopenta[b]quinolizine-2-carbaldehyde

(2S,3S,7S,10S)-3,7,10-trimethyldodecahydrocyclopenta[b]quinolizine-2-carbaldehyde

C16H27NO (249.20925319999998)


   

2,4-Dodecadienoic acid pyrrolidide

(2E,4E)-1-(pyrrolidin-1-yl)dodeca-2,4-dien-1-one

C16H27NO (249.20925319999998)


   

5-Butyl-4-hydroxy-3-methyl-6-(3-methyl-2-buten-1-yl)-2(1H)-pyridinone

5-Butyl-4-hydroxy-3-methyl-6-(3-methyl-2-buten-1-yl)-2(1H)-pyridinone

C15H23NO2 (249.1728698)


   

NA 16:3

N-Isobutyl-2E,4E,8Z-dodecatrienamide

C16H27NO (249.20925319999998)


   
   

(4-(2-(azepan-1-yl)ethoxy)phenyl)Methanol

(4-(2-(azepan-1-yl)ethoxy)phenyl)Methanol

C15H23NO2 (249.1728698)


   

1,2-Ethanediamine, N1-(2-aminoethyl)-N2-[3-(dimethoxymethylsilyl)propyl]

1,2-Ethanediamine, N1-(2-aminoethyl)-N2-[3-(dimethoxymethylsilyl)propyl]

C10H27N3O2Si (249.1872442)


   
   

1-(4-amino-5-Methoxy-2-Methylphenyl)-N,N-dimethylpiperidin-4-amine

1-(4-amino-5-Methoxy-2-Methylphenyl)-N,N-dimethylpiperidin-4-amine

C14H23N3O (249.18410279999998)


   

2-methoxy-4-[2-(4-methylpiperazin-1-yl)ethyl]aniline

2-methoxy-4-[2-(4-methylpiperazin-1-yl)ethyl]aniline

C14H23N3O (249.18410279999998)


   

2-[(3,4-DIMETHOXYPHENYL)METHYL]HEXAHYDRO-1H-AZEPINE,

2-[(3,4-DIMETHOXYPHENYL)METHYL]HEXAHYDRO-1H-AZEPINE,

C15H23NO2 (249.1728698)


   

3-AMINO-4-(4-ISOPROPYL-BENZYL)-PENTANOIC ACID

3-AMINO-4-(4-ISOPROPYL-BENZYL)-PENTANOIC ACID

C15H23NO2 (249.1728698)


   

8-hydroxy-3,4-dihydro-3-(dipropylamino)-2H-1-benzopyran

8-hydroxy-3,4-dihydro-3-(dipropylamino)-2H-1-benzopyran

C15H23NO2 (249.1728698)


   

6-(dipropylamino)-3,4,5,6,7,8-hexahydro-2H-naphthalen-1-one

6-(dipropylamino)-3,4,5,6,7,8-hexahydro-2H-naphthalen-1-one

C16H27NO (249.20925319999998)


   

Ciramadol

Ciramadol

C15H23NO2 (249.1728698)


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

   

Mabuprofen

3-[(1-METHYL-2-PHENYLETHYL)AMINO]PROPIONONITRILEHYDROCHLORIDE

C15H23NO2 (249.1728698)


C78272 - Agent Affecting Nervous System > C241 - Analgesic Agent > C2198 - Nonnarcotic Analgesic

   
   

(2,4,6-Triethylbenzene-1,3,5-triyl)trimethanamine

(2,4,6-Triethylbenzene-1,3,5-triyl)trimethanamine

C15H27N3 (249.22048619999998)


   

N-[(2,5-dimethoxyphenyl)methyl]cyclohexanamine

N-[(2,5-dimethoxyphenyl)methyl]cyclohexanamine

C15H23NO2 (249.1728698)


   

Diethylaminomethyltriethoxy

Diethylaminomethyltriethoxy

C11H27NO3Si (249.1760112)


   

POLYHEXAMETHYLENEGUANIDINEHYDROCHLORIDE

POLYHEXAMETHYLENEGUANIDINEHYDROCHLORIDE

C10H24ClN5 (249.17201339999997)


   

3-[4-(4-methoxyphenyl)piperazin-1-yl]propan-1-amine

3-[4-(4-methoxyphenyl)piperazin-1-yl]propan-1-amine

C14H23N3O (249.18410279999998)


   

4-TERT-BUTYL-2-(PHENOXYMETHYL)-MORPHOLINE

4-TERT-BUTYL-2-(PHENOXYMETHYL)-MORPHOLINE

C15H23NO2 (249.1728698)


   

di-tert-butyl diethylphosphoramidite

di-tert-butyl diethylphosphoramidite

C12H28NO2P (249.1857558)


   

2-Ethylhexyl 4-aminobenzoate

2-Ethylhexyl 4-aminobenzoate

C15H23NO2 (249.1728698)


   

1-[1-(3,4-Dimethoxyphenyl)cyclohexyl]methanamine

1-[1-(3,4-Dimethoxyphenyl)cyclohexyl]methanamine

C15H23NO2 (249.1728698)


   

1-deoxy-1-nitro-d-iditol hemihydrate

1-deoxy-1-nitro-d-iditol hemihydrate

C6H13NO7.1/2H2O (249.236255)


   

N-(2-Aminoethyl)-N-[3-(dimethoxymethylsilyl)propyl]-1,2-ethanediamine

N-(2-Aminoethyl)-N-[3-(dimethoxymethylsilyl)propyl]-1,2-ethanediamine

C10H27N3O2Si (249.1872442)


   

(4-(2-(4-methylpiperazin-1-yl)ethoxy)phenyl)methanamine

(4-(2-(4-methylpiperazin-1-yl)ethoxy)phenyl)methanamine

C14H23N3O (249.18410279999998)


   

4-(DIBUTYLAMINO)SALICYLALDEHYDE

4-(DIBUTYLAMINO)SALICYLALDEHYDE

C15H23NO2 (249.1728698)


   

(E)-1-(2,3-dihydro-1H-pyrrol-1-yl)-2-methyldec-8-ene-1,3-dione

(E)-1-(2,3-dihydro-1H-pyrrol-1-yl)-2-methyldec-8-ene-1,3-dione

C15H23NO2 (249.1728698)


A member of the class of pyrroles that is 2,3-dihydro-1H-pyrrole substituted by a 9-methyl-8,10-dioxodec-2-en-10-yl group at the nitrogen atom. Isolated from Penicillium citrinum and Penicillium brevicompactum, it exhibits antifungal activity.

   
   

(1S)-2-[(2S,5R)-2-(Aminomethyl)-5-ethynylpyrrolidin-1-YL]-1-cyclopentyl-2-oxoethanamine

(1S)-2-[(2S,5R)-2-(Aminomethyl)-5-ethynylpyrrolidin-1-YL]-1-cyclopentyl-2-oxoethanamine

C14H23N3O (249.18410279999998)


   

Tramadol, O-desmethyl

Tramadol, O-desmethyl

C15H23NO2 (249.1728698)


   

(7Z,10Z,13Z)-hexadecatrienoate

(7Z,10Z,13Z)-hexadecatrienoate

C16H25O2- (249.18544500000002)


A hexadecatrienoate that is the conjugate base of (7Z,10Z,13Z)-hexadecatrienoic acid, obtained by deprotonation of the carboxy group; major species at pH 7.3.

   

7-Aza-15-azoniatetracyclo[7.7.1.02,7.010,15]heptadecan-6-one

7-Aza-15-azoniatetracyclo[7.7.1.02,7.010,15]heptadecan-6-one

C15H25N2O+ (249.196678)


   

7-Aza-15-azoniatetracyclo[7.7.1.02,7.010,15]heptadecan-8-one

7-Aza-15-azoniatetracyclo[7.7.1.02,7.010,15]heptadecan-8-one

C15H25N2O+ (249.196678)


   

Lupanine(1+)

Lupanine(1+)

C15H25N2O+ (249.196678)


An organic cation that is the conjugate acid of lupanine, arising from protonation of the tertiary amino function; major species at pH 7.3.

   

[2-(2,6-Dimethylanilino)-2-oxoethyl]-diethyl-methylammonium

[2-(2,6-Dimethylanilino)-2-oxoethyl]-diethyl-methylammonium

C15H25N2O+ (249.196678)


   

5-butyl-4-hydroxy-3-methyl-6-(3-methylbut-2-enyl)-1H-pyridin-2-one

5-butyl-4-hydroxy-3-methyl-6-(3-methylbut-2-enyl)-1H-pyridin-2-one

C15H23NO2 (249.1728698)


   
   

1-[(2E,4E)-2,4-dodecadienoyl]pyrrolidine

1-[(2E,4E)-2,4-dodecadienoyl]pyrrolidine

C16H27NO (249.20925319999998)


A natural product found in Piper boehmeriaefolium.

   

Hexadecatrienoate

Hexadecatrienoate

C16H25O2 (249.18544500000002)


A polyunsaturated fatty acid anion obtained by deprotonation of the carboxy group of any hexadecatrienoic acid; major species at pH 7.3.

   
   

n-[(1as,4s,4as,7s,7ar,7br)-1,1,4,7-tetramethyl-octahydro-1ah-cyclopropa[e]azulen-4-yl]carboximidic acid

n-[(1as,4s,4as,7s,7ar,7br)-1,1,4,7-tetramethyl-octahydro-1ah-cyclopropa[e]azulen-4-yl]carboximidic acid

C16H27NO (249.20925319999998)


   

(2e,4e)-1-(piperidin-1-yl)deca-2,4-diene-1,6-dione

(2e,4e)-1-(piperidin-1-yl)deca-2,4-diene-1,6-dione

C15H23NO2 (249.1728698)


   

(4ar,7ar)-2-[(5e)-hept-5-en-1-yl]-3-methyl-4ah,5h,6h,7h,7ah-pyrano[2,3-b]pyrrol-4-one

(4ar,7ar)-2-[(5e)-hept-5-en-1-yl]-3-methyl-4ah,5h,6h,7h,7ah-pyrano[2,3-b]pyrrol-4-one

C15H23NO2 (249.1728698)


   

n-[(1s,2s,4ar,8as)-2-isopropyl-4a-methyl-8-methylidene-octahydronaphthalen-1-yl]carboximidic acid

n-[(1s,2s,4ar,8as)-2-isopropyl-4a-methyl-8-methylidene-octahydronaphthalen-1-yl]carboximidic acid

C16H27NO (249.20925319999998)


   

n-{1,1,4,7-tetramethyl-octahydro-1ah-cyclopropa[e]azulen-4a-yl}carboximidic acid

n-{1,1,4,7-tetramethyl-octahydro-1ah-cyclopropa[e]azulen-4a-yl}carboximidic acid

C16H27NO (249.20925319999998)


   

n-{1-methyl-4-[(2e,4e)-6-methylhepta-2,4-dien-2-yl]cyclohexyl}carboximidic acid

n-{1-methyl-4-[(2e,4e)-6-methylhepta-2,4-dien-2-yl]cyclohexyl}carboximidic acid

C16H27NO (249.20925319999998)


   

n-[(1as,4r,4as,7s,7ar,7br)-1,1,4,7-tetramethyl-octahydro-1ah-cyclopropa[e]azulen-4-yl]carboximidic acid

n-[(1as,4r,4as,7s,7ar,7br)-1,1,4,7-tetramethyl-octahydro-1ah-cyclopropa[e]azulen-4-yl]carboximidic acid

C16H27NO (249.20925319999998)


   

1-(1,6-dioxo-2e,4 e-decadienyl)piperidine

NA

C15H23NO2 (249.1728698)


{"Ingredient_id": "HBIN000325","Ingredient_name": "1-(1,6-dioxo-2e,4 e-decadienyl)piperidine","Alias": "NA","Ingredient_formula": "C15H23NO2","Ingredient_Smile": "CCCCC(=O)C=CC=CC(=O)N1CCCCC1","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "SMIT15189","TCMID_id": "6464","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}

   

(1r,2r,10s,13r,14s,15r)-15-methyl-6-azatetracyclo[8.6.0.0¹,⁶.0²,¹³]hexadecan-14-ol

(1r,2r,10s,13r,14s,15r)-15-methyl-6-azatetracyclo[8.6.0.0¹,⁶.0²,¹³]hexadecan-14-ol

C16H27NO (249.20925319999998)


   

(2e)-4-[(2r,3r,6r)-6-(furan-3-yl)-3-methylpiperidin-2-yl]-2-methylbut-2-en-1-ol

(2e)-4-[(2r,3r,6r)-6-(furan-3-yl)-3-methylpiperidin-2-yl]-2-methylbut-2-en-1-ol

C15H23NO2 (249.1728698)


   

n-{2-[(2s,4ar,8s)-4a,8-dimethyl-3,4,5,6,7,8-hexahydro-2h-naphthalen-2-yl]propan-2-yl}carboximidic acid

n-{2-[(2s,4ar,8s)-4a,8-dimethyl-3,4,5,6,7,8-hexahydro-2h-naphthalen-2-yl]propan-2-yl}carboximidic acid

C16H27NO (249.20925319999998)


   

(1r,2r,10s,11r,13s,15r)-15-methyl-6-azatetracyclo[8.6.0.0¹,⁶.0²,¹³]hexadecan-11-ol

(1r,2r,10s,11r,13s,15r)-15-methyl-6-azatetracyclo[8.6.0.0¹,⁶.0²,¹³]hexadecan-11-ol

C16H27NO (249.20925319999998)


   

n-[(1s,2s,3s,5s,6r,7r)-5-isopropyl-1,3-dimethyltricyclo[4.3.1.0³,⁷]decan-2-yl]carboximidic acid

n-[(1s,2s,3s,5s,6r,7r)-5-isopropyl-1,3-dimethyltricyclo[4.3.1.0³,⁷]decan-2-yl]carboximidic acid

C16H27NO (249.20925319999998)


   

(2e,4e,8z)-n-(2-methylpropyl)dodeca-2,4,8-trienimidic acid

(2e,4e,8z)-n-(2-methylpropyl)dodeca-2,4,8-trienimidic acid

C16H27NO (249.20925319999998)


   

(2e,4e)-1-[(4s)-4-hydroxy-3,4-dihydro-2h-pyridin-1-yl]deca-2,4-dien-1-one

(2e,4e)-1-[(4s)-4-hydroxy-3,4-dihydro-2h-pyridin-1-yl]deca-2,4-dien-1-one

C15H23NO2 (249.1728698)


   

n-[(1s,2r,4ar,8as)-2-isopropyl-4a-methyl-8-methylidene-octahydronaphthalen-1-yl]carboximidic acid

n-[(1s,2r,4ar,8as)-2-isopropyl-4a-methyl-8-methylidene-octahydronaphthalen-1-yl]carboximidic acid

C16H27NO (249.20925319999998)


   

n-[(1s,2r,3r,5s,6r,8r)-5-isopropyl-2,8-dimethyltricyclo[4.3.1.0³,⁸]decan-2-yl]carboximidic acid

n-[(1s,2r,3r,5s,6r,8r)-5-isopropyl-2,8-dimethyltricyclo[4.3.1.0³,⁸]decan-2-yl]carboximidic acid

C16H27NO (249.20925319999998)


   

2-methyl-1-(pyrrol-1-yl)decane-1,3-dione

2-methyl-1-(pyrrol-1-yl)decane-1,3-dione

C15H23NO2 (249.1728698)


   

4-[6-(furan-3-yl)-3-methylpiperidin-2-yl]-2-methylbut-2-en-1-ol

4-[6-(furan-3-yl)-3-methylpiperidin-2-yl]-2-methylbut-2-en-1-ol

C15H23NO2 (249.1728698)


   

n-[(1s)-1-[(1s,3as,7as)-3a-methyl-7-methylidene-hexahydro-1h-inden-1-yl]-2-methylpropyl]carboximidic acid

n-[(1s)-1-[(1s,3as,7as)-3a-methyl-7-methylidene-hexahydro-1h-inden-1-yl]-2-methylpropyl]carboximidic acid

C16H27NO (249.20925319999998)


   

n-[(1s,4s)-1-methyl-4-[(2e,4e)-6-methylhepta-2,4-dien-2-yl]cyclohexyl]carboximidic acid

n-[(1s,4s)-1-methyl-4-[(2e,4e)-6-methylhepta-2,4-dien-2-yl]cyclohexyl]carboximidic acid

C16H27NO (249.20925319999998)


   

n-(3-methoxybutyl)-3-pentylaniline

n-(3-methoxybutyl)-3-pentylaniline

C16H27NO (249.20925319999998)


   

n-[(2s,5s,10s)-7-isopropyl-2,10-dimethylspiro[4.5]dec-6-en-2-yl]carboximidic acid

n-[(2s,5s,10s)-7-isopropyl-2,10-dimethylspiro[4.5]dec-6-en-2-yl]carboximidic acid

C16H27NO (249.20925319999998)


   

n-[1-(3a-methyl-7-methylidene-hexahydro-1h-inden-1-yl)-2-methylpropyl]carboximidic acid

n-[1-(3a-methyl-7-methylidene-hexahydro-1h-inden-1-yl)-2-methylpropyl]carboximidic acid

C16H27NO (249.20925319999998)


   

n-[(1as,4s,4as,7s,7ar,7bs)-1,1,4,7-tetramethyl-octahydro-1ah-cyclopropa[e]azulen-4a-yl]carboximidic acid

n-[(1as,4s,4as,7s,7ar,7bs)-1,1,4,7-tetramethyl-octahydro-1ah-cyclopropa[e]azulen-4a-yl]carboximidic acid

C16H27NO (249.20925319999998)


   

n-[(2r,5r,10s)-7-isopropyl-2,10-dimethylspiro[4.5]dec-6-en-2-yl]carboximidic acid

n-[(2r,5r,10s)-7-isopropyl-2,10-dimethylspiro[4.5]dec-6-en-2-yl]carboximidic acid

C16H27NO (249.20925319999998)


   

15-methyl-6-azatetracyclo[8.6.0.0¹,⁶.0²,¹³]hexadecan-11-ol

15-methyl-6-azatetracyclo[8.6.0.0¹,⁶.0²,¹³]hexadecan-11-ol

C16H27NO (249.20925319999998)


   

15-methyl-6-azatetracyclo[8.6.0.0¹,⁶.0²,¹³]hexadecan-14-ol

15-methyl-6-azatetracyclo[8.6.0.0¹,⁶.0²,¹³]hexadecan-14-ol

C16H27NO (249.20925319999998)


   

(1s,4s,7s,8r,11s,12r,13s)-13-isopropyl-12-methyl-10-oxa-2-azatetracyclo[5.4.1.1⁸,¹¹.0⁴,¹²]tridecan-9-one

(1s,4s,7s,8r,11s,12r,13s)-13-isopropyl-12-methyl-10-oxa-2-azatetracyclo[5.4.1.1⁸,¹¹.0⁴,¹²]tridecan-9-one

C15H23NO2 (249.1728698)


   

n-[(1ar,4r,4as,7r,7as,7bs)-1,1,4,7-tetramethyl-octahydro-1ah-cyclopropa[e]azulen-4-yl]carboximidic acid

n-[(1ar,4r,4as,7r,7as,7bs)-1,1,4,7-tetramethyl-octahydro-1ah-cyclopropa[e]azulen-4-yl]carboximidic acid

C16H27NO (249.20925319999998)


   

1-(2,3-dihydropyrrol-1-yl)-2-methyldec-8-ene-1,3-dione

1-(2,3-dihydropyrrol-1-yl)-2-methyldec-8-ene-1,3-dione

C15H23NO2 (249.1728698)


   

n-[(1s,2s,4ar,8r,8as)-4a,8-dimethyl-2-(prop-1-en-2-yl)-octahydro-1h-naphthalen-1-yl]carboximidic acid

n-[(1s,2s,4ar,8r,8as)-4a,8-dimethyl-2-(prop-1-en-2-yl)-octahydro-1h-naphthalen-1-yl]carboximidic acid

C16H27NO (249.20925319999998)


   

(8as)-2-[(5e)-hept-5-en-1-yl]-3-methyl-6h,7h,8h,8ah-pyrrolo[2,1-b][1,3]oxazin-4-one

(8as)-2-[(5e)-hept-5-en-1-yl]-3-methyl-6h,7h,8h,8ah-pyrrolo[2,1-b][1,3]oxazin-4-one

C15H23NO2 (249.1728698)


   

n-[1,4a-dimethyl-8-(prop-1-en-2-yl)-octahydronaphthalen-1-yl]carboximidic acid

n-[1,4a-dimethyl-8-(prop-1-en-2-yl)-octahydronaphthalen-1-yl]carboximidic acid

C16H27NO (249.20925319999998)


   

n-[(1r,2s,4ar,8ar)-2-isopropyl-4a-methyl-8-methylidene-octahydronaphthalen-1-yl]carboximidic acid

n-[(1r,2s,4ar,8ar)-2-isopropyl-4a-methyl-8-methylidene-octahydronaphthalen-1-yl]carboximidic acid

C16H27NO (249.20925319999998)


   

n-[(1as,3ar,7r,7ar,7bs)-1,1,3a,7-tetramethyl-octahydrocyclopropa[a]naphthalen-7-yl]carboximidic acid

n-[(1as,3ar,7r,7ar,7bs)-1,1,3a,7-tetramethyl-octahydrocyclopropa[a]naphthalen-7-yl]carboximidic acid

C16H27NO (249.20925319999998)


   

2-(hept-6-en-1-yl)-6-(pent-4-en-1-yl)piperidine

2-(hept-6-en-1-yl)-6-(pent-4-en-1-yl)piperidine

C17H31N (249.24563659999998)


   

(2r)-2-methyl-1-(pyrrol-1-yl)decane-1,3-dione

(2r)-2-methyl-1-(pyrrol-1-yl)decane-1,3-dione

C15H23NO2 (249.1728698)


   

2-(hept-5-en-1-yl)-3-methyl-6h,7h,8h,8ah-pyrrolo[2,1-b][1,3]oxazin-4-one

2-(hept-5-en-1-yl)-3-methyl-6h,7h,8h,8ah-pyrrolo[2,1-b][1,3]oxazin-4-one

C15H23NO2 (249.1728698)


   

2-(hept-5-en-1-yl)-3-methyl-4ah,5h,6h,7h,7ah-pyrano[2,3-b]pyrrol-4-one

2-(hept-5-en-1-yl)-3-methyl-4ah,5h,6h,7h,7ah-pyrano[2,3-b]pyrrol-4-one

C15H23NO2 (249.1728698)


   

(8e)-1-(2,3-dihydropyrrol-1-yl)-2-methyldec-8-ene-1,3-dione

(8e)-1-(2,3-dihydropyrrol-1-yl)-2-methyldec-8-ene-1,3-dione

C15H23NO2 (249.1728698)


   

n-[2-(4a,8-dimethyl-3,4,5,6,7,8-hexahydro-2h-naphthalen-2-yl)propan-2-yl]carboximidic acid

n-[2-(4a,8-dimethyl-3,4,5,6,7,8-hexahydro-2h-naphthalen-2-yl)propan-2-yl]carboximidic acid

C16H27NO (249.20925319999998)


   

3-butyl-5-methoxy-n-pentylaniline

3-butyl-5-methoxy-n-pentylaniline

C16H27NO (249.20925319999998)


   

1-(4-hydroxy-3,4-dihydro-2h-pyridin-1-yl)deca-2,4-dien-1-one

1-(4-hydroxy-3,4-dihydro-2h-pyridin-1-yl)deca-2,4-dien-1-one

C15H23NO2 (249.1728698)


   

n-[(5s,6r,7s,10r)-7-isopropyl-2,10-dimethylspiro[4.5]dec-1-en-6-yl]carboximidic acid

n-[(5s,6r,7s,10r)-7-isopropyl-2,10-dimethylspiro[4.5]dec-1-en-6-yl]carboximidic acid

C16H27NO (249.20925319999998)


   

n-[(1s,2r,5s,6s,8r,9s)-9-isopropyl-1,5-dimethyltricyclo[4.4.0.0²,⁸]decan-5-yl]carboximidic acid

n-[(1s,2r,5s,6s,8r,9s)-9-isopropyl-1,5-dimethyltricyclo[4.4.0.0²,⁸]decan-5-yl]carboximidic acid

C16H27NO (249.20925319999998)


   

n-{1,1,3a,7-tetramethyl-octahydrocyclopropa[a]naphthalen-7-yl}carboximidic acid

n-{1,1,3a,7-tetramethyl-octahydrocyclopropa[a]naphthalen-7-yl}carboximidic acid

C16H27NO (249.20925319999998)


   

n-[(1ar,4r,4ar,7r,7ar,7bs)-1,1,4,7-tetramethyl-octahydro-1ah-cyclopropa[e]azulen-4-yl]carboximidic acid

n-[(1ar,4r,4ar,7r,7ar,7bs)-1,1,4,7-tetramethyl-octahydro-1ah-cyclopropa[e]azulen-4-yl]carboximidic acid

C16H27NO (249.20925319999998)


   

(2e)-4-[(2s,3r,6s)-6-(furan-3-yl)-3-methylpiperidin-2-yl]-2-methylbut-2-en-1-ol

(2e)-4-[(2s,3r,6s)-6-(furan-3-yl)-3-methylpiperidin-2-yl]-2-methylbut-2-en-1-ol

C15H23NO2 (249.1728698)


   

(1s,2s,10r,11r,13r,15s)-15-methyl-6-azatetracyclo[8.6.0.0¹,⁶.0²,¹³]hexadecan-11-ol

(1s,2s,10r,11r,13r,15s)-15-methyl-6-azatetracyclo[8.6.0.0¹,⁶.0²,¹³]hexadecan-11-ol

C16H27NO (249.20925319999998)


   
   

6-(furan-3-yl)-3,9-dimethyl-octahydroquinolizin-3-ol

6-(furan-3-yl)-3,9-dimethyl-octahydroquinolizin-3-ol

C15H23NO2 (249.1728698)


   

n-[(1r,4as,8s,8ar)-1,4a-dimethyl-8-(prop-1-en-2-yl)-octahydronaphthalen-1-yl]carboximidic acid

n-[(1r,4as,8s,8ar)-1,4a-dimethyl-8-(prop-1-en-2-yl)-octahydronaphthalen-1-yl]carboximidic acid

C16H27NO (249.20925319999998)


   

(3r,6s,9r,9as)-6-(furan-3-yl)-3,9-dimethyl-octahydroquinolizin-3-ol

(3r,6s,9r,9as)-6-(furan-3-yl)-3,9-dimethyl-octahydroquinolizin-3-ol

C15H23NO2 (249.1728698)


   

n-[4a,8-dimethyl-2-(prop-1-en-2-yl)-octahydro-1h-naphthalen-1-yl]carboximidic acid

n-[4a,8-dimethyl-2-(prop-1-en-2-yl)-octahydro-1h-naphthalen-1-yl]carboximidic acid

C16H27NO (249.20925319999998)


   

n-{7-isopropyl-2,10-dimethylspiro[4.5]dec-1-en-6-yl}carboximidic acid

n-{7-isopropyl-2,10-dimethylspiro[4.5]dec-1-en-6-yl}carboximidic acid

C16H27NO (249.20925319999998)


   

n-{7-isopropyl-2,10-dimethylspiro[4.5]dec-6-en-2-yl}carboximidic acid

n-{7-isopropyl-2,10-dimethylspiro[4.5]dec-6-en-2-yl}carboximidic acid

C16H27NO (249.20925319999998)


   

n-[(1as,4r,4ar,7s,7ar,7br)-1,1,4,7-tetramethyl-octahydro-1ah-cyclopropa[e]azulen-4-yl]carboximidic acid

n-[(1as,4r,4ar,7s,7ar,7br)-1,1,4,7-tetramethyl-octahydro-1ah-cyclopropa[e]azulen-4-yl]carboximidic acid

C16H27NO (249.20925319999998)


   

n-{1,1,4,7-tetramethyl-octahydro-1ah-cyclopropa[e]azulen-4-yl}carboximidic acid

n-{1,1,4,7-tetramethyl-octahydro-1ah-cyclopropa[e]azulen-4-yl}carboximidic acid

C16H27NO (249.20925319999998)


   

n-(2-isopropyl-4a-methyl-8-methylidene-octahydronaphthalen-1-yl)carboximidic acid

n-(2-isopropyl-4a-methyl-8-methylidene-octahydronaphthalen-1-yl)carboximidic acid

C16H27NO (249.20925319999998)


   

[(3r,6s,9r,9as)-6-(furan-3-yl)-9-methyl-octahydro-1h-quinolizin-3-yl]methanol

[(3r,6s,9r,9as)-6-(furan-3-yl)-9-methyl-octahydro-1h-quinolizin-3-yl]methanol

C15H23NO2 (249.1728698)


   

[6-(furan-3-yl)-9-methyl-octahydro-1h-quinolizin-3-yl]methanol

[6-(furan-3-yl)-9-methyl-octahydro-1h-quinolizin-3-yl]methanol

C15H23NO2 (249.1728698)


   

n-[1,4a-dimethyl-7-(prop-1-en-2-yl)-octahydronaphthalen-1-yl]carboximidic acid

n-[1,4a-dimethyl-7-(prop-1-en-2-yl)-octahydronaphthalen-1-yl]carboximidic acid

C16H27NO (249.20925319999998)


   

1-(pyrrolidin-1-yl)dodeca-2,4-dien-1-one

1-(pyrrolidin-1-yl)dodeca-2,4-dien-1-one

C16H27NO (249.20925319999998)


   

(2s,3r,6s)-6-[(1e,3e,5e)-deca-1,3,5-trien-1-yl]-2-methylpiperidin-3-ol

(2s,3r,6s)-6-[(1e,3e,5e)-deca-1,3,5-trien-1-yl]-2-methylpiperidin-3-ol

C16H27NO (249.20925319999998)


   

n-[(1r,4ar,7s,8ar)-1,4a-dimethyl-7-(prop-1-en-2-yl)-octahydronaphthalen-1-yl]carboximidic acid

n-[(1r,4ar,7s,8ar)-1,4a-dimethyl-7-(prop-1-en-2-yl)-octahydronaphthalen-1-yl]carboximidic acid

C16H27NO (249.20925319999998)


   

n-[(5s,6r,7s,10s)-7-isopropyl-2,10-dimethylspiro[4.5]dec-1-en-6-yl]carboximidic acid

n-[(5s,6r,7s,10s)-7-isopropyl-2,10-dimethylspiro[4.5]dec-1-en-6-yl]carboximidic acid

C16H27NO (249.20925319999998)


   

(1r)-6-methoxy-2-methyl-1-(2-methylpropyl)-3,4-dihydro-1h-isoquinolin-7-ol

(1r)-6-methoxy-2-methyl-1-(2-methylpropyl)-3,4-dihydro-1h-isoquinolin-7-ol

C15H23NO2 (249.1728698)


   

(2r,8e)-1-(2,3-dihydropyrrol-1-yl)-2-methyldec-8-ene-1,3-dione

(2r,8e)-1-(2,3-dihydropyrrol-1-yl)-2-methyldec-8-ene-1,3-dione

C15H23NO2 (249.1728698)


   

1-(piperidin-1-yl)deca-2,4-diene-1,6-dione

1-(piperidin-1-yl)deca-2,4-diene-1,6-dione

C15H23NO2 (249.1728698)