CHEBI:143139 - (9S),10-epoxy-(10,12Z)-octadecadienoate

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name (9S),10-epoxy-(10,12Z)-octadecadienoate
ChEBI ID CHEBI:143139
ChEBI ASCII Name (9S),10-epoxy-(10,12Z)-octadecadienoate
Definition A long-chain unsaturated fatty acid anion that is the conjugate base of (9S),10-epoxy-(10,12Z)-octadecadienoic acid, arising from deprotonation of the carboxylic acid group.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter Lucila Aimo
Supplier Information
Download Molfile XML SDF
Formula C18H29O3
Net Charge -1
Average Mass 293.428
Monoisotopic Mass 293.21222
InChI InChI=1S/C18H30O3/c1-2-3-4-5-7-10-13-16-17(21-16)14-11-8-6-9-12-15-18(19)20/h7,10,13,17H,2-6,8-9,11-12,14-15H2,1H3,(H,19,20)/p-1/b10-7-,16-13?/t17-/m0/s1
InChIKey LVVCDOSOKGYQFY-IDQNXFEJSA-M
SMILES C([O-])(=O)CCCCCCC[C@H]1C(=C(/C=C\CCCCC)[H])O1
ChEBI Ontology
Outgoing (9S),10-epoxy-(10,12Z)-octadecadienoate (CHEBI:143139) has functional parent linoleate (CHEBI:30245)
(9S),10-epoxy-(10,12Z)-octadecadienoate (CHEBI:143139) is a long-chain fatty acid anion (CHEBI:57560)
(9S),10-epoxy-(10,12Z)-octadecadienoate (CHEBI:143139) is a polyunsaturated fatty acid anion (CHEBI:76567)
(9S),10-epoxy-(10,12Z)-octadecadienoate (CHEBI:143139) is conjugate base of (9S),10-epoxy-(10,12Z)-octadecadienoic acid (CHEBI:143790)
Incoming (9S),10-epoxy-(10,12Z)-octadecadienoic acid (CHEBI:143790) is conjugate acid of (9S),10-epoxy-(10,12Z)-octadecadienoate (CHEBI:143139)
IUPAC Name
8-{(2S)-3-[(2Z)-oct-2-en-1-ylidene]oxiran-2-yl}octanoate
Synonyms Sources
(9S),10-epoxy-(10,12Z)-octadecadienoic acid(1−) ChEBI
9S,10-epoxy-(10,12Z)-octadecadienoate UniProt
Citation Waiting for Citations Type Source
17046828 PubMed citation SUBMITTER
Last Modified
08 June 2019