U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ABSOLUTE
Molecular Formula C18H32O3
Molecular Weight 296.4449
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of VERNOLIC ACID, CIS-(+)-

SMILES

CCCCC[C@H]1O[C@H]1C\C=C/CCCCCCCC(O)=O

InChI

InChIKey=CCPPLLJZDQAOHD-GJGKEFFFSA-N
InChI=1S/C18H32O3/c1-2-3-10-13-16-17(21-16)14-11-8-6-4-5-7-9-12-15-18(19)20/h8,11,16-17H,2-7,9-10,12-15H2,1H3,(H,19,20)/b11-8-/t16-,17+/m1/s1

HIDE SMILES / InChI

Molecular Formula C18H32O3
Molecular Weight 296.4449
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 1
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 09:18:00 GMT 2023
Edited
by admin
on Sat Dec 16 09:18:00 GMT 2023
Record UNII
FR42854EPW
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
VERNOLIC ACID, CIS-(+)-
Common Name English
(+)-12,13-EPOXY-9-CIS-OCTADECENOIC ACID
Systematic Name English
OLEIC ACID, 12,13-EPOXY-, (12S,13R)-(+)-
Common Name English
9-UNDECENOIC ACID, 11-((2S,3R)-3-PENTYL-2-OXIRANYL)-, (9Z)-
Systematic Name English
(+)-VERNOLIC ACID
Common Name English
OCTADEC-CIS-(+)-12,13-EPOXY-CIS-9-ENOIC ACID
Systematic Name English
VERNOLIC ACID
Common Name English
VERNOLEIC ACID
Common Name English
VERNOLIC ACID (+)-FORM [MI]
Common Name English
CIS-(+)-12,13-EPOXYOCTADEC-CIS-9-ENOIC ACID
Systematic Name English
Code System Code Type Description
CHEBI
27706
Created by admin on Sat Dec 16 09:18:00 GMT 2023 , Edited by admin on Sat Dec 16 09:18:00 GMT 2023
PRIMARY
CAS
503-07-1
Created by admin on Sat Dec 16 09:18:00 GMT 2023 , Edited by admin on Sat Dec 16 09:18:00 GMT 2023
PRIMARY
CHEBI
38300
Created by admin on Sat Dec 16 09:18:00 GMT 2023 , Edited by admin on Sat Dec 16 09:18:00 GMT 2023
PRIMARY
EPA CompTox
DTXSID40895851
Created by admin on Sat Dec 16 09:18:00 GMT 2023 , Edited by admin on Sat Dec 16 09:18:00 GMT 2023
PRIMARY
PUBCHEM
6449780
Created by admin on Sat Dec 16 09:18:00 GMT 2023 , Edited by admin on Sat Dec 16 09:18:00 GMT 2023
PRIMARY
FDA UNII
FR42854EPW
Created by admin on Sat Dec 16 09:18:00 GMT 2023 , Edited by admin on Sat Dec 16 09:18:00 GMT 2023
PRIMARY
MERCK INDEX
m11429
Created by admin on Sat Dec 16 09:18:00 GMT 2023 , Edited by admin on Sat Dec 16 09:18:00 GMT 2023
PRIMARY Merck Index