(6E)-N-((4-HYDROXY-3-METHOXYPHENYL)METHYL)-8-METHYL-6,8-NONADIENAMIDE

Details

Stereochemistry	ACHIRAL
Molecular Formula	C18H25NO3
Molecular Weight	303.396
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure of (6E)-N-((4-HYDROXY-3-METHOXYPHENYL)METHYL)-8-METHYL-6,8-NONADIENAMIDE

Structure Search

SMILES

COC1=CC(CNC(=O)CCCC\C=C\C(C)=C)=CC=C1O

InChI

InChIKey=LSIRKKJMETWUBA-SOFGYWHQSA-N

InChI=1S/C18H25NO3/c1-14(2)8-6-4-5-7-9-18(21)19-13-15-10-11-16(20)17(12-15)22-3/h6,8,10-12,20H,1,4-5,7,9,13H2,2-3H3,(H,19,21)/b8-6+

HIDE SMILES / InChI

Molecular Formula	C18H25NO3
Molecular Weight	303.396
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	1
Optical Activity	NONE

Approval Year

Substance Class	Chemical Created by `admin` on `Wed Apr 02 11:46:51 GMT 2025` Edited by `admin` on `Wed Apr 02 11:46:51 GMT 2025`
Record UNII	6YV3X8VC5J
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

(6E)-N-((4-HYDROXY-3-METHOXYPHENYL)METHYL)-8-METHYL-6,8-NONADIENAMIDE

Systematic Name

English

16,17-DEHYDRO-CAPSAICIN

Preferred Name

English

6,8-NONADIENAMIDE, N-((4-HYDROXY-3-METHOXYPHENYL)METHYL)-8-METHYL-, (6E)-

Systematic Name

English

Code System Code Type Description

FDA UNII

6YV3X8VC5J

Created by admin on Wed Apr 02 11:46:51 GMT 2025 , Edited by admin on Wed Apr 02 11:46:51 GMT 2025

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PUBCHEM

71315300

Created by admin on Wed Apr 02 11:46:51 GMT 2025 , Edited by admin on Wed Apr 02 11:46:51 GMT 2025

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CAS

509101-57-9

Created by admin on Wed Apr 02 11:46:51 GMT 2025 , Edited by admin on Wed Apr 02 11:46:51 GMT 2025

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EPA CompTox

DTXSID80747441

Created by admin on Wed Apr 02 11:46:51 GMT 2025 , Edited by admin on Wed Apr 02 11:46:51 GMT 2025

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Related Record Type Details


					S07O44R1ZM

CAPSAICIN

PARENT -> METABOLITE

Comments:

In human microsomal fraction, 16,17-dehydro-capsaicin was the minor metabolite, but in human S-9 fraction, 16,17-dehydro-capsaicin was the major metabolite.

Qualification:

PLASMA