Isoricinoleic acid (CHEBI:165774)

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.

ChEBI Name	Isoricinoleic acid

ChEBI ID	CHEBI:165774

Stars	This entity has been manually annotated by a third party.

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C18H34O3

Net Charge

Average Mass

298.467

Monoisotopic Mass

298.25079

InChI

InChI=1S/C18H34O3/c1-2-3-4-5-6-8-11-14-17(19)15-12-9-7-10-13-16-18(20)21/h6,8,17,19H,2-5,7,9-16H2,1H3,(H,20,21)/b8-6-

InChIKey

BNZYDQIAPCVNAT-VURMDHGXSA-N

SMILES

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

Roles Classification
Chemical Role(s):	Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Bronsted base). (via oxoacid )

ChEBI Ontology
Outgoing	Isoricinoleic acid (CHEBI:165774) is a long-chain fatty acid (CHEBI:15904)

IUPAC Name

(Z)-9-hydroxyoctadec-12-enoic acid