METHYL .ALPHA.-DIMORPHECOLATE, (9S)-

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C19H34O3
Molecular Weight	310.4715
Optical Activity	( + )
Defined Stereocenters	1 / 1
E/Z Centers	2
Charge	0

SHOW SMILES / InChI

Structure of METHYL .ALPHA.-DIMORPHECOLATE, (9S)-

Structure Search

SMILES

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

InChI

InChIKey=WRXGTVUDZZBNPN-QPHMHISKSA-N

InChI=1S/C19H34O3/c1-3-4-5-6-7-9-12-15-18(20)16-13-10-8-11-14-17-19(21)22-2/h7,9,12,15,18,20H,3-6,8,10-11,13-14,16-17H2,1-2H3/b9-7-,15-12+/t18-/m1/s1

HIDE SMILES / InChI

Molecular Formula	C19H34O3
Molecular Weight	310.4715
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 19:50:53 GMT 2025` Edited by `admin` on `Tue Apr 01 19:50:53 GMT 2025`
Record UNII	B7J5Z3V9R3
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

METHYL .ALPHA.-DIMORPHECOLATE, (9S)-

Common Name

English

(9S,10E,12Z)-9-HYDROXYOCTADECA-10,12-DIENOIC ACID METHYL ESTER

Preferred Name

English

10,12-OCTADECADIENOIC ACID, 9-HYDROXY-, METHYL ESTER, (E,Z)-D-

Systematic Name

English

METHYL (9S,10E,12Z)-9-HYDROXY-10,12-OCTADECADIENOATE

Systematic Name

English

10,12-OCTADECADIENOIC ACID, 9-HYDROXY-, METHYL ESTER, (9S,10E,12Z)-

Systematic Name

English

Code System Code Type Description

CAS

10075-07-7

Created by admin on Tue Apr 01 19:50:53 GMT 2025 , Edited by admin on Tue Apr 01 19:50:53 GMT 2025

PRIMARY

FDA UNII

B7J5Z3V9R3

Created by admin on Tue Apr 01 19:50:53 GMT 2025 , Edited by admin on Tue Apr 01 19:50:53 GMT 2025

PRIMARY

PUBCHEM

10913935

Created by admin on Tue Apr 01 19:50:53 GMT 2025 , Edited by admin on Tue Apr 01 19:50:53 GMT 2025

PRIMARY

Related Record Type Details


					XQ4LZ46VEU

METHYL .ALPHA.-DIMORPHECOLATE, (±)-

RACEMATE -> ENANTIOMER

Amount: