3e,9z,12z,15z-octadecatetraenoic acid (CHEBI:230563)

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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	3e,9z,12z,15z-octadecatetraenoic acid

ChEBI ID	CHEBI:230563

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

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C18H28O2

Net Charge

Average Mass

276.420

Monoisotopic Mass

276.20893

InChI

InChI=1S/C18H28O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h3-4,6-7,9-10,15-16H,2,5,8,11-14,17H2,1H3,(H,19,20)/b4-3-,7-6-,10-9-,16-15+

InChIKey

JNIPNHCEUZIVID-BPJKAVOUSA-N

SMILES

OC(=O)C\C=C\CCCC/C=C\C/C=C\C/C=C\CC

Metabolite of Species	Details
Homo sapiens (NCBI:txid9606)	Found in feces (BTO:0000440). See: MetaboLights Study

ChEBI Ontology
Outgoing	3e,9z,12z,15z-octadecatetraenoic acid (CHEBI:230563) is a organic molecular entity (CHEBI:50860)

IUPAC Name

(3E,9Z,12Z,15Z)-octadeca-3,9,12,15-tetraenoic acid