CHEBI:34494 - 9(10)-EpOME

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 9(10)-EpOME
ChEBI ID CHEBI:34494
Definition An EpOME obtained by formal epoxidation of the 9,10-double bond of octadeca-9,12-dienoic acid (the 12Z-geoisomer).
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information ChemicalBook:CB6252771, eMolecules:524854, ZINC000001532731
Download Molfile XML SDF
Formula C18H32O3
Net Charge 0
Average Mass 296.44490
Monoisotopic Mass 296.23514
InChI InChI=1S/C18H32O3/c1-2-3-4-5-7-10-13-16-17(21-16)14-11-8-6-9-12-15-18(19)20/h7,10,16-17H,2-6,8-9,11-15H2,1H3,(H,19,20)/b10-7-
InChIKey FBUKMFOXMZRGRB-YFHOEESVSA-N
SMILES CCCCC\C=C/CC1OC1CCCCCCCC(O)=O
Roles Classification
Chemical Role(s): Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
Biological Role(s): metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
(via epoxyoctadecenoic acid )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 9(10)-EpOME (CHEBI:34494) is a epoxyoctadecenoic acid (CHEBI:72659)
9(10)-EpOME (CHEBI:34494) is conjugate acid of 9(10)-EpOME(1−) (CHEBI:84023)
Incoming (9R,10S)-9(10)-EpOME (CHEBI:86022) is a 9(10)-EpOME (CHEBI:34494)
9(10)-EpOME(1−) (CHEBI:84023) is conjugate base of 9(10)-EpOME (CHEBI:34494)
IUPAC Name
8-{3-[(2Z)-oct-2-en-1-yl]oxiran-2-yl}octanoic acid
Synonyms Sources
9(10)-epoxyoctadec-12Z-enoic acid ChEBI
9,10-EOA HMDB
9,10-epoxy-12Z-octadecenoic acid LIPID MAPS
9,10-epoxyoctadec-12(Z)-enoic acid HMDB
9,10-epoxyoctadecenoic acid HMDB
Coronaric acid LIPID MAPS
Manual Xrefs Databases
HMDB0004701 HMDB
LMFA02000037 LIPID MAPS
View more database links
Registry Number Type Source
4318495 Reaxys Registry Number Reaxys
Last Modified
23 October 2015