9H-12(13)-EpODE (CHEBI:165763)

CHEBI:165763 - 9H-12(13)-EpODE

Formula	C18H30O4
Net Charge	0
Average Mass	310.434
Monoisotopic Mass	310.21441
SMILES	CC/C=C\C[C@@H]1O[C@@H]1/C=C/[C@@H](O)CCCCCCCC(=O)O
InChI	InChI=1S/C18H30O4/c1-2-3-7-11-16-17(22-16)14-13-15(19)10-8-5-4-6-9-12-18(20)21/h3,7,13-17,19H,2,4-6,8-12H2,1H3,(H,20,21)/b7-3-,14-13+/t15-,16-,17+/m0/s1
InChIKey	MGYJEJUWQRJNBN-OADLNGDBSA-N

Roles Classification

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

ChEBI Ontology

Outgoing Relation(s)
	9H-12(13)-EpODE (CHEBI:165763) is a long-chain fatty acid (CHEBI:15904)

IUPAC Name
(E,9S)-9-hydroxy-11-[(2R,3S)-3-[(Z)-pent-2-enyl]oxiran-2-yl]undec-10-enoic acid

Manual Xrefs	Databases
17220737	ChemSpider
LMFA02000020	LIPID MAPS