CHEBI:15653 - (9Z,13S,15Z)-12,13-epoxyoctadeca-9,11,15-trienoic acid

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ChEBI Name (9Z,13S,15Z)-12,13-epoxyoctadeca-9,11,15-trienoic acid
ChEBI ID CHEBI:15653
ChEBI ASCII Name (9Z,13S,15Z)-12,13-epoxyoctadeca-9,11,15-trienoic acid
Definition A long-chain trienoic fatty acid consisting of octadecanoic acid having the three double bonds at positions 9, 11 and 15 as well as an epoxy ring linking positions 12 and 13.
Stars This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs CHEBI:262, CHEBI:18616
Supplier Information
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Formula C18H28O3
Net Charge 0
Average Mass 292.41310
Monoisotopic Mass 292.20384
InChI InChI=1S/C18H28O3/c1-2-3-10-13-16-17(21-16)14-11-8-6-4-5-7-9-12-15-18(19)20/h3,8,10-11,14,16H,2,4-7,9,12-13,15H2,1H3,(H,19,20)/b10-3-,11-8-,17-14?/t16-/m0/s1
InChIKey YZBZORUZOSCZRN-YWHLHSFDSA-N
SMILES [H]C(\C=C/CCCCCCCC(O)=O)=C1O[C@H]1C\C=C/CC
Roles Classification
Chemical Role(s): Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing (9Z,13S,15Z)-12,13-epoxyoctadeca-9,11,15-trienoic acid (CHEBI:15653) has functional parent 9,11,15-octadecatrienoic acid (CHEBI:38387)
(9Z,13S,15Z)-12,13-epoxyoctadeca-9,11,15-trienoic acid (CHEBI:15653) is a epoxy fatty acid (CHEBI:61498)
(9Z,13S,15Z)-12,13-epoxyoctadeca-9,11,15-trienoic acid (CHEBI:15653) is a long-chain fatty acid (CHEBI:15904)
(9Z,13S,15Z)-12,13-epoxyoctadeca-9,11,15-trienoic acid (CHEBI:15653) is a trienoic fatty acid (CHEBI:73155)
(9Z,13S,15Z)-12,13-epoxyoctadeca-9,11,15-trienoic acid (CHEBI:15653) is conjugate acid of (9Z,13S,15Z)-12,13-epoxyoctadeca-9,11,15-trienoate (CHEBI:36438)
Incoming (9Z,13S,15Z)-12,13-epoxyoctadeca-9,11,15-trienoate (CHEBI:36438) is conjugate base of (9Z,13S,15Z)-12,13-epoxyoctadeca-9,11,15-trienoic acid (CHEBI:15653)
IUPAC Name
(9Z)-11-{(3S)-3-[(2Z)-pent-2-en-1-yl]oxiran-2-ylidene}undec-9-enoic acid
Synonyms Sources
(9Z)-(13S)-12,13-Epoxyoctadeca-9,11,15-trienoate KEGG COMPOUND
(9Z,15Z)-(13S)-12,13-Epoxyoctadeca-9,11,15-trienoate KEGG COMPOUND
(9Z,15Z)-(13S)-12,13-Epoxyoctadeca-9,11,15-trienoic acid KEGG COMPOUND
12,13(S)-EOT KEGG COMPOUND
12,13(S)-EOTrE KEGG COMPOUND
12,13(S)-epoxy-9(Z),11,15(Z)-octadecatrienoic acid ChEBI
12,13(S)-epoxylinolenic acid MetaCyc
12,13-EOT MetaCyc
Manual Xrefs Databases
C04672 KEGG COMPOUND
CPD-728 MetaCyc
LMFA02000053 LIPID MAPS
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Last Modified
04 August 2014