7E,9Z,12Z-octadecatrienoic acid (CHEBI:180186)

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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	7E,9Z,12Z-octadecatrienoic acid

ChEBI ID	CHEBI:180186

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

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C18H30O2

Net Charge

Average Mass

278.436

Monoisotopic Mass

278.22458

InChI

InChI=1S/C18H30O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h6-7,9-12H,2-5,8,13-17H2,1H3,(H,19,20)/b7-6-,10-9-,12-11+

InChIKey

RTILLKWKMLNKLK-JSHIYTDESA-N

SMILES

OC(=O)CCCCC/C=C/C=C\C/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	7E,9Z,12Z-octadecatrienoic acid (CHEBI:180186) is a octadecatrienoic acid (CHEBI:25633)

IUPAC Name

(7E,9Z,12Z)-octadeca-7,9,12-trienoic acid

Last Modified

23 February 2022