AFFININ

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C14H23NO
Molecular Weight	221.3385
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	3
Charge	0

SHOW SMILES / InChI

Structure of AFFININ

Structure Search

SMILES

C\C=C\C=C/CC\C=C\C(=O)NCC(C)C

InChI

InChIKey=BXOCHUWSGYYSFW-HVWOQQCMSA-N

InChI=1S/C14H23NO/c1-4-5-6-7-8-9-10-11-14(16)15-12-13(2)3/h4-7,10-11,13H,8-9,12H2,1-3H3,(H,15,16)/b5-4+,7-6-,11-10+

HIDE SMILES / InChI

Molecular Formula	C14H23NO
Molecular Weight	221.3385
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	3
Optical Activity	NONE

Approval Year

Substance Class	Chemical Created by `admin` on `Mon Mar 31 22:00:38 GMT 2025` Edited by `admin` on `Mon Mar 31 22:00:38 GMT 2025`
Record UNII	4W9L3S4856
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

AFFININ [MI]

Preferred Name

English

AFFININ

Common Name

English

N-ISOBUTYLDECA-TRANS-2,CIS-6,TRANS-8-TRIENAMIDE

Common Name

English

FEMA NO. 4668

Code

English

2,6,8-DECATRIENAMIDE, N-ISOBUTYL-, (E,E,Z)-

Systematic Name

English

SPILANTHOL

Common Name

English

2,6,8-DECATRIENAMIDE, N-(2-METHYLPROPYL)-, (2E,6Z,8E)-

Systematic Name

English

Code System Code Type Description

CAS

25394-57-4

Created by admin on Mon Mar 31 22:00:38 GMT 2025 , Edited by admin on Mon Mar 31 22:00:38 GMT 2025

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MERCK INDEX

m1440

Created by admin on Mon Mar 31 22:00:38 GMT 2025 , Edited by admin on Mon Mar 31 22:00:38 GMT 2025

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Merck Index

EPA CompTox

DTXSID90893963

Created by admin on Mon Mar 31 22:00:38 GMT 2025 , Edited by admin on Mon Mar 31 22:00:38 GMT 2025

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WIKIPEDIA

SPILANTHOL

Created by admin on Mon Mar 31 22:00:38 GMT 2025 , Edited by admin on Mon Mar 31 22:00:38 GMT 2025

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PUBCHEM

5353001

Created by admin on Mon Mar 31 22:00:38 GMT 2025 , Edited by admin on Mon Mar 31 22:00:38 GMT 2025

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JECFA MONOGRAPH

2054

Created by admin on Mon Mar 31 22:00:38 GMT 2025 , Edited by admin on Mon Mar 31 22:00:38 GMT 2025

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CAS

856322-12-8

Created by admin on Mon Mar 31 22:00:38 GMT 2025 , Edited by admin on Mon Mar 31 22:00:38 GMT 2025

NON-SPECIFIC STEREOCHEMISTRY

FDA UNII

4W9L3S4856

Created by admin on Mon Mar 31 22:00:38 GMT 2025 , Edited by admin on Mon Mar 31 22:00:38 GMT 2025

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