Chemical Formula: C13H17NO

Chemical Formula C13H17NO

Found 80 metabolite its formula value is C13H17NO

Crotamiton

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

C13H17NO (203.1310072)


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

   

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

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

C13H17NO (203.1310072)


   
   

(-)-Aphanorphine

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

C13H17NO (203.1310072)


   

4-Acetyl-4-phenylpiperidine

4-Acetyl-4-phenylpiperidine

C13H17NO (203.1310072)


   

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

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

C13H17NO (203.1310072)


   

Deschloroketamine

Deschloroketamine

C13H17NO (203.1310072)


   
   

Selegiline N-oxide

Selegiline N-oxide

C13H17NO (203.1310072)


   

alpha-Pyrrolidinopropiophenone

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

C13H17NO (203.1310072)


   

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

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

C13H17NO (203.1310072)


   
   

(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 (203.1310072)


   

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

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

C13H17NO (203.1310072)


   

R-Deprenyl N-Oxide

R-Deprenyl N-Oxide

C13H17NO (203.1310072)


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

   

Crotamiton

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

C13H17NO (203.1310072)


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

   

DEP_204.1383_10.9

DEP_204.1383_10.9

C13H17NO (203.1310072)


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

   

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

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

C13H17NO (203.1310072)


   

(4-methylphenyl)-piperidin-4-ylmethanone

(4-methylphenyl)-piperidin-4-ylmethanone

C13H17NO (203.1310072)


   

1-Benzyl-azepan-3-one

1-Benzyl-azepan-3-one

C13H17NO (203.1310072)


   

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

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

C13H17NO (203.1310072)


   

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

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

C13H17NO (203.1310072)


   

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 (203.1310072)


   

1-Benzyl-4-methyl-3-piperidinone

1-Benzyl-4-methyl-3-piperidinone

C13H17NO (203.1310072)


   

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

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

C13H17NO (203.1310072)


   

4-hexoxybenzonitrile

4-hexoxybenzonitrile

C13H17NO (203.1310072)


   

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

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

C13H17NO (203.1310072)


   

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

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

C13H17NO (203.1310072)


   

1-Benzyl-4-azepanone

1-Benzyl-4-azepanone

C13H17NO (203.1310072)


   

1-benzyl-2-methylpiperidin-4-one

1-benzyl-2-methylpiperidin-4-one

C13H17NO (203.1310072)


   

(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 (203.1310072)


   

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

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

C13H17NO (203.1310072)


   

2-(4-(Pentyloxy)phenyl)acetonitrile

2-(4-(Pentyloxy)phenyl)acetonitrile

C13H17NO (203.1310072)


   

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

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

C13H17NO (203.1310072)


   

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

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

C13H17NO (203.1310072)


   

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

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

C13H17NO (203.1310072)


   

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

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

C13H17NO (203.1310072)


   

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

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

C13H17NO (203.1310072)


   

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

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

C13H17NO (203.1310072)


   

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

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

C13H17NO (203.1310072)


   

4-Piperidinoacetophenone

4-Piperidinoacetophenone

C13H17NO (203.1310072)


   

4-(piperidin-1-ylmethyl)benzaldehyde

4-(piperidin-1-ylmethyl)benzaldehyde

C13H17NO (203.1310072)


   

3-(PIPERIDINOMETHYL)BENZALDEHYDE

3-(PIPERIDINOMETHYL)BENZALDEHYDE

C13H17NO (203.1310072)


   

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

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

C13H17NO (203.1310072)


   

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

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

C13H17NO (203.1310072)


   

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

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

C13H17NO (203.1310072)


   

2,6-di-iso-propylphenyl isocyanate

2,6-di-iso-propylphenyl isocyanate

C13H17NO (203.1310072)


   

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

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

C13H17NO (203.1310072)


   

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

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

C13H17NO (203.1310072)


   

trans-4-(Diethylamino)cinnamaldehyde

trans-4-(Diethylamino)cinnamaldehyde

C13H17NO (203.1310072)


   

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

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

C13H17NO (203.1310072)


   

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 (203.1310072)


   

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

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

C13H17NO (203.1310072)


   

(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 (203.1310072)


   

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

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

C13H17NO (203.1310072)


   

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

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

C13H17NO (203.1310072)


   

1-Benzylpiperidine-4-carbaldehyde

1-Benzylpiperidine-4-carbaldehyde

C13H17NO (203.1310072)


   

1-Phenethyl-4-piperidone

1-Phenethyl-4-piperidone

C13H17NO (203.1310072)


   

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

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

C13H17NO (203.1310072)


   

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

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

C13H17NO (203.1310072)


   

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 (203.1310072)


   

2,6-DICHLORO-4-NITROANISOLE

2,6-DICHLORO-4-NITROANISOLE

C13H17NO (203.1310072)


   

4-Benzylaminocyclohexanone

4-Benzylaminocyclohexanone

C13H17NO (203.1310072)


   

1-Benzyl-3-methyl-4-piperidinone

1-Benzyl-3-methyl-4-piperidinone

C13H17NO (203.1310072)


   

5-(tert-Butyl)-2-ethylbenzoxazole

5-(tert-Butyl)-2-ethylbenzoxazole

C13H17NO (203.1310072)


   

Spiro[isochroman-1,4-piperidine]

Spiro[isochroman-1,4-piperidine]

C13H17NO (203.1310072)


   

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

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

C13H17NO (203.1310072)


   

ALDH1A3-IN-2

ALDH1A3-IN-2

C13H17NO (203.1310072)


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].

   

(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 (203.1310072)


   

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

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

C13H17NO (203.1310072)


   

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

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

C13H17NO (203.1310072)


   

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

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

C13H17NO (203.1310072)


   

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

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

C13H17NO (203.1310072)


   

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 (203.1310072)


   

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 (203.1310072)


   

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

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

C13H17NO (203.1310072)


   

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

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

C13H17NO (203.1310072)


   

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

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

C13H17NO (203.1310072)


   

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

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

C13H17NO (203.1310072)