CHEBI:75327 - (8S,9S)-epoxy-(10R)-hydroxyicosa-(5Z,11Z,14Z)-trienoate

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name (8S,9S)-epoxy-(10R)-hydroxyicosa-(5Z,11Z,14Z)-trienoate
ChEBI ID CHEBI:75327
ChEBI ASCII Name (8S,9S)-epoxy-(10R)-hydroxyicosa-(5Z,11Z,14Z)-trienoate
Definition An unsaturated fatty acid anion that is the conjugate base of (8S,9S)-epoxy-(10R)-hydroxyicosa-(5Z,11Z,14Z)-trienoic acid, obtained by deprotonation of the carboxy group.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter KAX
Supplier Information
Download Molfile XML SDF
Formula C20H31O4
Net Charge -1
Average Mass 335.45770
Monoisotopic Mass 335.22278
InChI InChI=1S/C20H32O4/c1-2-3-4-5-6-7-8-11-14-17(21)20-18(24-20)15-12-9-10-13-16-19(22)23/h6-7,9,11-12,14,17-18,20-21H,2-5,8,10,13,15-16H2,1H3,(H,22,23)/p-1/b7-6-,12-9-,14-11-/t17-,18-,20+/m0/s1
InChIKey WWOUHSVXNYZFBQ-MCRRFWBCSA-M
SMILES CCCCC\C=C/C\C=C/[C@H](O)[C@H]1O[C@H]1C\C=C/CCCC([O-])=O
ChEBI Ontology
Outgoing (8S,9S)-epoxy-(10R)-hydroxyicosa-(5Z,11Z,14Z)-trienoate (CHEBI:75327) is a epoxy(hydroxy)icosatrienoate (CHEBI:137328)
(8S,9S)-epoxy-(10R)-hydroxyicosa-(5Z,11Z,14Z)-trienoate (CHEBI:75327) is conjugate base of (8S,9S)-epoxy-(10R)-hydroxyicosa-(5Z,11Z,14Z)-trienoic acid (CHEBI:75822)
Incoming (8S,9S)-epoxy-(10R)-hydroxyicosa-(5Z,11Z,14Z)-trienoic acid (CHEBI:75822) is conjugate acid of (8S,9S)-epoxy-(10R)-hydroxyicosa-(5Z,11Z,14Z)-trienoate (CHEBI:75327)
IUPAC Name
(5Z)-7-{(2S,3R)-3-[(1S,2Z,5Z)-1-hydroxyundeca-2,5-dien-1-yl]oxiran-2-yl}hept-5-enoate
Synonym Source
(10R)-hydroxy-(8S,9S)-epoxy-(5Z,11Z,14Z)-eicosatrienoate UniProt
Citation Waiting for Citations Type Source
17045234 PubMed citation SUBMITTER
Last Modified
16 November 2017