13-HYDROPEROXY-9,11-OCTADECADIENOIC ACID, (9Z,11Z,13S)-

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C18H32O4
Molecular Weight	312.4443
Optical Activity	UNSPECIFIED
Defined Stereocenters	1 / 1
E/Z Centers	2
Charge	0

SHOW SMILES / InChI

Structure of 13-HYDROPEROXY-9,11-OCTADECADIENOIC ACID, (9Z,11Z,13S)-

Structure Search

SMILES

CCCCC[C@H](OO)\C=C/C=C\CCCCCCCC(O)=O

InChI

InChIKey=JDSRHVWSAMTSSN-JWFBTYQQSA-N

InChI=1S/C18H32O4/c1-2-3-11-14-17(22-21)15-12-9-7-5-4-6-8-10-13-16-18(19)20/h7,9,12,15,17,21H,2-6,8,10-11,13-14,16H2,1H3,(H,19,20)/b9-7-,15-12-/t17-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C18H32O4
Molecular Weight	312.4443
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	1 / 1
E/Z Centers	2
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Tue Apr 01 16:41:04 GMT 2025` Edited by `admin` on `Tue Apr 01 16:41:04 GMT 2025`
Record UNII	4P9V8UQ4UN
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

13-HYDROPEROXY-9,11-OCTADECADIENOIC ACID, (9Z,11Z,13S)-

Systematic Name

English

(9Z,11Z,13S)-13-(HYDROPEROXY)-9,11-OCTADECADIENOIC ACID

Preferred Name

English

9,11-OCTADECADIENOIC ACID, 13-HYDROPEROXY-, (S-(Z,Z))-

Systematic Name

English

9,11-OCTADECADIENOIC ACID, 13-HYDROPEROXY-, (9Z,11Z,13S)-

Systematic Name

English

Code System Code Type Description

FDA UNII

4P9V8UQ4UN

Created by admin on Tue Apr 01 16:41:04 GMT 2025 , Edited by admin on Tue Apr 01 16:41:04 GMT 2025

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PUBCHEM

13234548

Created by admin on Tue Apr 01 16:41:04 GMT 2025 , Edited by admin on Tue Apr 01 16:41:04 GMT 2025

PRIMARY

CAS

40878-62-4

Created by admin on Tue Apr 01 16:41:04 GMT 2025 , Edited by admin on Tue Apr 01 16:41:04 GMT 2025

PRIMARY

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13-HYDROPEROXY-9,11-OCTADECADIENOIC ACID, (9Z,11Z)-

RACEMATE -> ENANTIOMER

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