Record Information
Version1.0
StatusDetected and Quantified
Creation Date2022-06-05 22:51:48 UTC
Update Date2022-09-01 02:27:04 UTC
Metabolite IDMMDBc0054081
Metabolite Identification
Common Name(9Z)-octadecenoic acid
Descriptionoleate, also known as oleic acid anion, belongs to the class of organic compounds known as long-chain fatty acids. These are fatty acids with an aliphatic tail that contains between 13 and 21 carbon atoms. oleate is a weakly acidic compound (based on its pKa).
Structure
Synonyms
ValueSource
(9Z)-OctadecenoateChEBI
(Z)-9-Octadecenoic acid, ion(1-)ChEBI
cis-9-OctadecenoateChEBI
OleatChEBI
Oleic acid anionChEBI
(9Z)-Octadecenoic acidGenerator
(Z)-9-Octadecenoate, ion(1-)Generator
cis-9-Octadecenoic acidGenerator
Oleate anionGenerator
Oleic acidGenerator
Molecular FormulaC18H33O2
Average Mass281.4534
Monoisotopic Mass281.2480553
IUPAC Name(9Z)-octadec-9-enoate
Traditional Nameoleate
CAS Registry NumberNot Available
SMILES
CCCCCCCC\C=C/CCCCCCCC([O-])=O
InChI Identifier
InChI=1S/C18H34O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h9-10H,2-8,11-17H2,1H3,(H,19,20)/p-1/b10-9-
InChI KeyZQPPMHVWECSIRJ-KTKRTIGZSA-M