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

EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

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

Take structure to advanced search

ChEBI ID	CHEBI:229818
ChEBI Name	19-methyl-5e,9e-eicosadienoic acid
Stars
Submitter	MetaboLights
Downloads	Molfile

Formula	C21H38O2
Net Charge	0
Average Mass	322.533
Monoisotopic Mass	322.28718
SMILES	CC(C)CCCCCCCC/C=C/CC/C=C/CCCC(=O)O
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

Species of Metabolite	Component	Source	Comments
Homo sapiens (ncbitaxon:9606)	feces (BTO:0000440)	MetaboLights (MTBLS9087)

Roles Classification

Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Brønsted base).

ChEBI Ontology

Outgoing Relation(s)
	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

Manual Xrefs	Databases
4471741	ChemSpider
LMFA01020224	LIPID MAPS