19-methyl-5e,9e-eicosadienoic acid (CHEBI:229818)

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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	19-methyl-5e,9e-eicosadienoic acid

ChEBI ID	CHEBI:229818

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

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C21H38O2

Net Charge

Average Mass

322.533

Monoisotopic Mass

322.28718

InChI

InChI=1S/C21H38O2/c1-20(2)18-16-14-12-10-8-6-4-3-5-7-9-11-13-15-17-19-21(22)23/h3,5,11,13,20H,4,6-10,12,14-19H2,1-2H3,(H,22,23)/b5-3+,13-11+

InChIKey

UZWGJGWPRAVRBC-SDGZKQAHSA-N

SMILES

OC(=O)CCC\C=C\CC\C=C\CCCCCCCCC(C)C

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

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	19-methyl-5e,9e-eicosadienoic acid (CHEBI:229818) is a long-chain fatty acid (CHEBI:15904)

IUPAC Name

(5E,9E)-19-methylicosa-5,9-dienoic acid