Chemical Formula: C12H17NO3

Chemical Formula C12H17NO3

Found 92 metabolite its formula value is C12H17NO3

Cerulenin

(2R,3S)-3-(Nona-4,7-dienoyl)oxirane-2-carboximidate

C12H17NO3 (223.1208372)


Cerulenin is an antifungal antibiotic that inhibits sterol and fatty acid biosynthesis. In fatty acid synthesis, reported to bind in equimolar ratio to b-keto-acyl-ACP synthase. In sterol synthesis, inhibits HMG-CoA synthetase activity. It is also shown to inhibit feeding and induce dramatic weight loss in mice. It is found naturally in the Cephalosporium caerulensfungus. [Wikipedia] D000963 - Antimetabolites > D000960 - Hypolipidemic Agents > D054872 - Fatty Acid Synthesis Inhibitors Acquisition and generation of the data is financially supported in part by CREST/JST. D057847 - Lipid Regulating Agents > D000960 - Hypolipidemic Agents D000890 - Anti-Infective Agents > D000935 - Antifungal Agents D009676 - Noxae > D000963 - Antimetabolites Cerulenin, a potent, natural inhibitor of fatty acid synthase (FASN), is an epoxide produced by the fungus Cephalosporium caeruleus. Cerulenin inhibits topoisomerase I catalytic activity and augments SN-38-induced apoptosis. Cerulenin has antifungal and antitumor activies[1][2][3][4]. Cerulenin, a potent, natural inhibitor of fatty acid synthase (FASN), is an epoxide produced by the fungus Cephalosporium caeruleus. Cerulenin inhibits topoisomerase I catalytic activity and augments SN-38-induced apoptosis. Cerulenin has antifungal and antitumor activies[1][2][3][4].

   

Nicoboxil

2-Butoxyethyl pyridine-3-carboxylic acid

C12H17NO3 (223.1208372)


C78272 - Agent Affecting Nervous System > C241 - Analgesic Agent Same as: D01677

   
   

bufexamac

bufexamac

C12H17NO3 (223.1208372)


M - Musculo-skeletal system > M02 - Topical products for joint and muscular pain > M02A - Topical products for joint and muscular pain > M02AA - Antiinflammatory preparations, non-steroids for topical use M - Musculo-skeletal system > M01 - Antiinflammatory and antirheumatic products > M01A - Antiinflammatory and antirheumatic products, non-steroids > M01AB - Acetic acid derivatives and related substances C78272 - Agent Affecting Nervous System > C241 - Analgesic Agent > C2198 - Nonnarcotic Analgesic D018373 - Peripheral Nervous System Agents > D018689 - Sensory System Agents D002491 - Central Nervous System Agents > D000700 - Analgesics D000893 - Anti-Inflammatory Agents D018501 - Antirheumatic Agents CONFIDENCE standard compound; EAWAG_UCHEM_ID 3322

   

Bucetin

3-Hydroxy-4-butyrophenetidide

C12H17NO3 (223.1208372)


N - Nervous system > N02 - Analgesics > N02B - Other analgesics and antipyretics > N02BE - Anilides C78272 - Agent Affecting Nervous System > C241 - Analgesic Agent CONFIDENCE standard compound; INTERNAL_ID 770; DATASET 20200303_ENTACT_RP_MIX507; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3469; ORIGINAL_PRECURSOR_SCAN_NO 3465 CONFIDENCE standard compound; INTERNAL_ID 770; DATASET 20200303_ENTACT_RP_MIX507; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3475; ORIGINAL_PRECURSOR_SCAN_NO 3473 CONFIDENCE standard compound; INTERNAL_ID 770; DATASET 20200303_ENTACT_RP_MIX507; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3486; ORIGINAL_PRECURSOR_SCAN_NO 3483 CONFIDENCE standard compound; INTERNAL_ID 770; DATASET 20200303_ENTACT_RP_MIX507; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3465; ORIGINAL_PRECURSOR_SCAN_NO 3462 CONFIDENCE standard compound; INTERNAL_ID 770; DATASET 20200303_ENTACT_RP_MIX507; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3484; ORIGINAL_PRECURSOR_SCAN_NO 3482 CONFIDENCE standard compound; INTERNAL_ID 770; DATASET 20200303_ENTACT_RP_MIX507; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 3508; ORIGINAL_PRECURSOR_SCAN_NO 3507 CONFIDENCE standard compound; INTERNAL_ID 770; DATASET 20200303_ENTACT_RP_MIX507; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 7495; ORIGINAL_PRECURSOR_SCAN_NO 7493 CONFIDENCE standard compound; INTERNAL_ID 770; DATASET 20200303_ENTACT_RP_MIX500; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 7483; ORIGINAL_PRECURSOR_SCAN_NO 7481 CONFIDENCE standard compound; INTERNAL_ID 770; DATASET 20200303_ENTACT_RP_MIX507; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 7505; ORIGINAL_PRECURSOR_SCAN_NO 7504 CONFIDENCE standard compound; INTERNAL_ID 770; DATASET 20200303_ENTACT_RP_MIX507; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 7516; ORIGINAL_PRECURSOR_SCAN_NO 7513 CONFIDENCE standard compound; INTERNAL_ID 770; DATASET 20200303_ENTACT_RP_MIX500; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 7539; ORIGINAL_PRECURSOR_SCAN_NO 7535 CONFIDENCE standard compound; INTERNAL_ID 770; DATASET 20200303_ENTACT_RP_MIX500; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 7505; ORIGINAL_PRECURSOR_SCAN_NO 7503

   

Rimiterol

4-[hydroxy(piperidin-2-yl)methyl]benzene-1,2-diol

C12H17NO3 (223.1208372)


   
   
   
   
   

Etamivan

ETHAMIVAN

C12H17NO3 (223.1208372)


R - Respiratory system > R07 - Other respiratory system products > R07A - Other respiratory system products > R07AB - Respiratory stimulants C78272 - Agent Affecting Nervous System > C47795 - CNS Stimulant

   

4-[2-(cyclohexen-1-yl)ethylamino]-4-oxobut-2-enoic acid

4-[2-(cyclohexen-1-yl)ethylamino]-4-oxobut-2-enoic acid

C12H17NO3 (223.1208372)


   

3,4-Dimethoxymethcathinone

3,4-Dimethoxymethcathinone

C12H17NO3 (223.1208372)


   

3-Methoxy-4,5-methylenedioxy-N-methylamphetamine

3-Methoxy-4,5-methylenedioxy-N-methylamphetamine

C12H17NO3 (223.1208372)


   

4-[2-(trimethylammonio)ethoxycarbonyl]phenolate

4-[2-(trimethylammonio)ethoxycarbonyl]phenolate

C12H17NO3 (223.1208372)


   

7,8-dimethoxy-1-methyl-1,2,3,4-tetrahydro-isoquinolin-6-ol

7,8-dimethoxy-1-methyl-1,2,3,4-tetrahydro-isoquinolin-6-ol

C12H17NO3 (223.1208372)


   
   

3-ethoxy-4-vinyl-3,4,4a,5,6,7-hexahydro-pyrano[3,4-c]pyridin-8-one|?藛1.8a-Isomer-Spicatine+

3-ethoxy-4-vinyl-3,4,4a,5,6,7-hexahydro-pyrano[3,4-c]pyridin-8-one|?藛1.8a-Isomer-Spicatine+

C12H17NO3 (223.1208372)


   

6,7,8-trimethoxy-1,2,3,4-tetrahydroquinoline

6,7,8-trimethoxy-1,2,3,4-tetrahydroquinoline

C12H17NO3 (223.1208372)


   

(6,7-Dimethoxy-1,2,3,4-tetrahydro-isoquinolin-1-yl)-methanol

(6,7-Dimethoxy-1,2,3,4-tetrahydro-isoquinolin-1-yl)-methanol

C12H17NO3 (223.1208372)


   
   
   

2-amino-5-(4-methoxyphenyl)pentanoic Acid

2-amino-5-(4-methoxyphenyl)pentanoic Acid

C12H17NO3 (223.1208372)


   

5,6,7-trimethoxy-1,2,3,4-tetrahydroisoquinoline

5,6,7-trimethoxy-1,2,3,4-tetrahydroisoquinoline

C12H17NO3 (223.1208372)


   

N-Acetylhomoveratrylamine

Acetamide, N-(3,4-dimethoxyphenethyl)- (8CI)

C12H17NO3 (223.1208372)


   

Cerulenin

cis-2-epoxy-4-oxo-7E,10E-dodecadienamide

C12H17NO3 (223.1208372)


An epoxydodecadienamide isolated from several species, including Acremonium, Acrocylindrum and Helicoceras. It inhibits the biosynthesis of several lipids by interfering with enzyme function. D000963 - Antimetabolites > D000960 - Hypolipidemic Agents > D054872 - Fatty Acid Synthesis Inhibitors D057847 - Lipid Regulating Agents > D000960 - Hypolipidemic Agents D000890 - Anti-Infective Agents > D000935 - Antifungal Agents D009676 - Noxae > D000963 - Antimetabolites Cerulenin, a potent, natural inhibitor of fatty acid synthase (FASN), is an epoxide produced by the fungus Cephalosporium caeruleus. Cerulenin inhibits topoisomerase I catalytic activity and augments SN-38-induced apoptosis. Cerulenin has antifungal and antitumor activies[1][2][3][4]. Cerulenin, a potent, natural inhibitor of fatty acid synthase (FASN), is an epoxide produced by the fungus Cephalosporium caeruleus. Cerulenin inhibits topoisomerase I catalytic activity and augments SN-38-induced apoptosis. Cerulenin has antifungal and antitumor activies[1][2][3][4].

   

N-acetyl homoveratrylamine

N-acetyl homoveratrylamine

C12H17NO3 (223.1208372)


   

Rimiterol

4-[hydroxy(piperidin-2-yl)methyl]benzene-1,2-diol

C12H17NO3 (223.1208372)


R - Respiratory system > R03 - Drugs for obstructive airway diseases > R03A - Adrenergics, inhalants > R03AC - Selective beta-2-adrenoreceptor agonists D018377 - Neurotransmitter Agents > D018663 - Adrenergic Agents > D000322 - Adrenergic Agonists C78272 - Agent Affecting Nervous System > C29747 - Adrenergic Agent > C87053 - Adrenergic Agonist

   

tert-Butyl (2-methoxyphenyl)carbamate

tert-Butyl (2-methoxyphenyl)carbamate

C12H17NO3 (223.1208372)


   

(3-HYDROXY-BENZYL)-CARBAMIC ACID TERT-BUTYL ESTER

(3-HYDROXY-BENZYL)-CARBAMIC ACID TERT-BUTYL ESTER

C12H17NO3 (223.1208372)


   
   

N-Boc-3-oxo-3-azabicyclo[3.2.1]oct-6-ene

N-Boc-3-oxo-3-azabicyclo[3.2.1]oct-6-ene

C12H17NO3 (223.1208372)


   

L-tyrosine isopropyl ester

L-tyrosine isopropyl ester

C12H17NO3 (223.1208372)


   

1-Hexyloxy-4-nitrobenzene

1-Hexyloxy-4-nitrobenzene

C12H17NO3 (223.1208372)


   

5-METHYL-4-PIPERIDIN-1-YLMETHYL-FURAN-2-CARBOXYLIC ACID

5-METHYL-4-PIPERIDIN-1-YLMETHYL-FURAN-2-CARBOXYLIC ACID

C12H17NO3 (223.1208372)


   

Ethyl 2-((4-methoxybenzyl)amino)acetate

Ethyl 2-((4-methoxybenzyl)amino)acetate

C12H17NO3 (223.1208372)


   

3-AMINO-3-(2,5-DIMETHYL-4-METHOXY-PHENYL)-PROPIONIC ACID

3-AMINO-3-(2,5-DIMETHYL-4-METHOXY-PHENYL)-PROPIONIC ACID

C12H17NO3 (223.1208372)


   

3-AMINO-3-(2-PROPOXYPHENYL)-PROPIONIC ACID

3-AMINO-3-(2-PROPOXYPHENYL)-PROPIONIC ACID

C12H17NO3 (223.1208372)


   

3-(4-PROPOXYPHENYL)-BETA-ALANINE

3-(4-PROPOXYPHENYL)-BETA-ALANINE

C12H17NO3 (223.1208372)


   

tert-Butyl (4-(hydroxymethyl)phenyl)carbamate

tert-Butyl (4-(hydroxymethyl)phenyl)carbamate

C12H17NO3 (223.1208372)


   

5-(azepan-1-ylmethyl)-2-furoic acid

5-(azepan-1-ylmethyl)-2-furoic acid

C12H17NO3 (223.1208372)


   

N-Benzyloxycarbonyl-(isopropoxyMethyl)amine

N-Benzyloxycarbonyl-(isopropoxyMethyl)amine

C12H17NO3 (223.1208372)


   

4-(Z-AMINO)-1-BUTANOL

4-(Z-AMINO)-1-BUTANOL

C12H17NO3 (223.1208372)


   

2-(Dimethylamino)-3,4-dimethoxyacetophenone

2-(Dimethylamino)-3,4-dimethoxyacetophenone

C12H17NO3 (223.1208372)


   

2-(tert-Butoxycarbonylaminomethyl)phenol

2-(tert-Butoxycarbonylaminomethyl)phenol

C12H17NO3 (223.1208372)


   

TERT-BUTYL 4,7-DIHYDROFURO[2,3-C]PYRIDINE-6(5H)-CARBOXYLATE

TERT-BUTYL 4,7-DIHYDROFURO[2,3-C]PYRIDINE-6(5H)-CARBOXYLATE

C12H17NO3 (223.1208372)


   

DL-N-Benzyl-β-hydroxyvalin

DL-N-Benzyl-β-hydroxyvalin

C12H17NO3 (223.1208372)


   

N-Boc-3-hydroxymethylaniline

N-Boc-3-hydroxymethylaniline

C12H17NO3 (223.1208372)


   

Ethyl 3-Methoxyphenethylcarbamate

Ethyl 3-Methoxyphenethylcarbamate

C12H17NO3 (223.1208372)


   

METHYL 2-[2-(DIMETHYLAMINO)ETHOXY]BENZOATE 97

METHYL 2-[2-(DIMETHYLAMINO)ETHOXY]BENZOATE 97

C12H17NO3 (223.1208372)


   

tert-butyl benzyloxycarbamate

tert-butyl benzyloxycarbamate

C12H17NO3 (223.1208372)


   

C-[1-(4-FLUORO-PHENYL)-CYCLOPENTYL]-METHYLAMINE

C-[1-(4-FLUORO-PHENYL)-CYCLOPENTYL]-METHYLAMINE

C12H17NO3 (223.1208372)


   

tert-butyl 4-amino-3-methoxybenzoate

tert-butyl 4-amino-3-methoxybenzoate

C12H17NO3 (223.1208372)


   

Methyl 4-cyclopropylbenzoate

Methyl 4-cyclopropylbenzoate

C12H17NO3 (223.1208372)


   

(S)-N-(1,5-DIHYDROXYPENTAN-2-YL)BENZAMIDE

(S)-N-(1,5-DIHYDROXYPENTAN-2-YL)BENZAMIDE

C12H17NO3 (223.1208372)


   

3-butoxy-4-methoxybenzamide

3-butoxy-4-methoxybenzamide

C12H17NO3 (223.1208372)


   
   

1-(furan-2-ylmethylamino)cyclohexane-1-carboxylic acid

1-(furan-2-ylmethylamino)cyclohexane-1-carboxylic acid

C12H17NO3 (223.1208372)


   

tert-Butyl-4-methoxycarbanilate

tert-Butyl-4-methoxycarbanilate

C12H17NO3 (223.1208372)


   

5-(TERT-BUTYL)-4,5,6,7-TETRAHYDROBENZO[D]ISOXAZOLE-3-CARBOXYLIC ACID

5-(TERT-BUTYL)-4,5,6,7-TETRAHYDROBENZO[D]ISOXAZOLE-3-CARBOXYLIC ACID

C12H17NO3 (223.1208372)


   

(4-HYDROXY-2-METHYLPHENYL)CARBAMIC ACID TERT-BUTYL ESTER

(4-HYDROXY-2-METHYLPHENYL)CARBAMIC ACID TERT-BUTYL ESTER

C12H17NO3 (223.1208372)


   

AMINO(4-BUTOXYPHENYL)ACETIC ACID

AMINO(4-BUTOXYPHENYL)ACETIC ACID

C12H17NO3 (223.1208372)


   

3-AMINO-3-(3-ISOPROPOXYPHENYL)PROPANOIC ACID

3-AMINO-3-(3-ISOPROPOXYPHENYL)PROPANOIC ACID

C12H17NO3 (223.1208372)


   

3-Amino-3-(4-isopropoxy-phenyl)-propionic acid

3-Amino-3-(4-isopropoxy-phenyl)-propionic acid

C12H17NO3 (223.1208372)


   

4-(2-DIMETHYLAMINO-ETHOXY)-3-METHOXY-BENZALDEHYDE

4-(2-DIMETHYLAMINO-ETHOXY)-3-METHOXY-BENZALDEHYDE

C12H17NO3 (223.1208372)


   

Ethyl [2-(4-methoxyphenyl)ethyl]carbamate

Ethyl [2-(4-methoxyphenyl)ethyl]carbamate

C12H17NO3 (223.1208372)


   

benzyl N-(4-hydroxybutan-2-yl)carbamate

benzyl N-(4-hydroxybutan-2-yl)carbamate

C12H17NO3 (223.1208372)


   

3-(cyclohexylamino)-4-ethoxycyclobut-3-ene-1,2-dione

3-(cyclohexylamino)-4-ethoxycyclobut-3-ene-1,2-dione

C12H17NO3 (223.1208372)


   

3-[2-(dimethylamino)ethoxy]-4-methoxybenzaldehyde

3-[2-(dimethylamino)ethoxy]-4-methoxybenzaldehyde

C12H17NO3 (223.1208372)


   

2-Methyl-2-propanyl (3-methoxyphenyl)carbamate

2-Methyl-2-propanyl (3-methoxyphenyl)carbamate

C12H17NO3 (223.1208372)


   

2-(3,4-Dimethoxyphenyl)morpholine

2-(3,4-Dimethoxyphenyl)morpholine

C12H17NO3 (223.1208372)


   

3-(2-Ethoxycarbonylethyl)-2,4-dimethyl-5-formylpyrrole

3-(2-Ethoxycarbonylethyl)-2,4-dimethyl-5-formylpyrrole

C12H17NO3 (223.1208372)


   

N-(2,2-dimethoxyethyl)-1-(4-methoxyphenyl)methanimine

N-(2,2-dimethoxyethyl)-1-(4-methoxyphenyl)methanimine

C12H17NO3 (223.1208372)


   

3-N-PROPOXYPICOLINIC ACID N-PROPYL ESTER

3-N-PROPOXYPICOLINIC ACID N-PROPYL ESTER

C12H17NO3 (223.1208372)


   

N-(2-HYDROXY-1,1-DIMETHYLETHYL)-2-METHOXYBENZENECARBOXAMIDE

N-(2-HYDROXY-1,1-DIMETHYLETHYL)-2-METHOXYBENZENECARBOXAMIDE

C12H17NO3 (223.1208372)


   

3-[(ALLYLAMINO)CARBONYL]BICYCLO[2.2.1]HEPTANE-2-CARBOXYLIC ACID

3-[(ALLYLAMINO)CARBONYL]BICYCLO[2.2.1]HEPTANE-2-CARBOXYLIC ACID

C12H17NO3 (223.1208372)


   

(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)methanol

(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)methanol

C12H17NO3 (223.1208372)


   

tert-Butyl (2-(hydroxymethyl)phenyl)carbamate

tert-Butyl (2-(hydroxymethyl)phenyl)carbamate

C12H17NO3 (223.1208372)


   

ETHYL 6-(TERT-BUTYL)-4-OXO-1,4-DIHYDROPYRIDINE-3-CARBOXYLATE

ETHYL 6-(TERT-BUTYL)-4-OXO-1,4-DIHYDROPYRIDINE-3-CARBOXYLATE

C12H17NO3 (223.1208372)


   

5-[(4-methylpiperidin-1-yl)methyl]-2-furoic acid

5-[(4-methylpiperidin-1-yl)methyl]-2-furoic acid

C12H17NO3 (223.1208372)


   

2-(3,5-Dimethoxyphenyl)morpholine

2-(3,5-Dimethoxyphenyl)morpholine

C12H17NO3 (223.1208372)


   

O,2,3-trimethyltyrosine

O,2,3-trimethyltyrosine

C12H17NO3 (223.1208372)


   

Nicoboxil

beta-Butoxyethyl nicotinate

C12H17NO3 (223.1208372)


C78272 - Agent Affecting Nervous System > C241 - Analgesic Agent Same as: D01677

   

2-(3-{3-[(1E)-prop-1-en-1-yl]oxiran-2-yl}oxiran-2-yl)-5,6-dihydro-1H-pyridin-2-ol

2-(3-{3-[(1E)-prop-1-en-1-yl]oxiran-2-yl}oxiran-2-yl)-5,6-dihydro-1H-pyridin-2-ol

C12H17NO3 (223.1208372)


   

(2R,3S)-3-(1-oxonona-4,7-dienyl)-2-oxiranecarboxamide

(2R,3S)-3-(1-oxonona-4,7-dienyl)-2-oxiranecarboxamide

C12H17NO3 (223.1208372)


   

N,N,N-trimethyltyrosine

N,N,N-trimethyltyrosine

C12H17NO3 (223.1208372)


   
   
   

(2R)-3-(4-hydroxyphenyl)-2-(trimethylazaniumyl)propanoate

(2R)-3-(4-hydroxyphenyl)-2-(trimethylazaniumyl)propanoate

C12H17NO3 (223.1208372)


   

D-O,2,3-trimethyltyrosine

D-O,2,3-trimethyltyrosine

C12H17NO3 (223.1208372)


   

L-O,2,3-trimethyltyrosine

L-O,2,3-trimethyltyrosine

C12H17NO3 (223.1208372)


A non-proteinogenic L-alpha-amino acid that is L-tyrosine in which the hydrogens at positions 2 and 3 as well as the phenolic hydrogen are replaced by methyl groups.