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Details

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

SHOW SMILES / InChI
Structure of METHYL .ALPHA.-DIMORPHECOLATE, (±)-

SMILES

CCCCC\C=C/C=C/C(O)CCCCCCCC(=O)OC

InChI

InChIKey=WRXGTVUDZZBNPN-BSZOFBHHSA-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+

HIDE SMILES / InChI

Molecular Formula C19H34O3
Molecular Weight 310.4715
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 2
Optical Activity ( + / - )

Approval Year

Substance Class Chemical
Created
by admin
on Tue Apr 01 19:46:25 GMT 2025
Edited
by admin
on Tue Apr 01 19:46:25 GMT 2025
Record UNII
XQ4LZ46VEU
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
10,12-OCTADECADIENOIC ACID, 9-HYDROXY-, METHYL ESTER, (10E,12Z)-
Preferred Name English
METHYL .ALPHA.-DIMORPHECOLATE, (±)-
Common Name English
METHYL (10E,12Z)-9-HYDROXY-10,12-OCTADECADIENOATE
Systematic Name English
METHYL 9-HYDROXY-TRANS-10-CIS-12-OCTADECADIENOATE
Systematic Name English
Code System Code Type Description
PUBCHEM
71356802
Created by admin on Tue Apr 01 19:46:25 GMT 2025 , Edited by admin on Tue Apr 01 19:46:25 GMT 2025
PRIMARY
CAS
6084-82-8
Created by admin on Tue Apr 01 19:46:25 GMT 2025 , Edited by admin on Tue Apr 01 19:46:25 GMT 2025
PRIMARY
FDA UNII
XQ4LZ46VEU
Created by admin on Tue Apr 01 19:46:25 GMT 2025 , Edited by admin on Tue Apr 01 19:46:25 GMT 2025
PRIMARY
Related Record Type Details
ENANTIOMER -> RACEMATE
ENANTIOMER -> RACEMATE