CHEBI:15654 - (9Z,13S)-12,13-epoxyoctadeca-9,11-dienoic acid

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name (9Z,13S)-12,13-epoxyoctadeca-9,11-dienoic acid
ChEBI ID CHEBI:15654
ChEBI ASCII Name (9Z,13S)-12,13-epoxyoctadeca-9,11-dienoic acid
Definition The (9Z)-isomer of (13S)-12,13-epoxyoctadeca-9,11-dienoic acid.
Stars This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs CHEBI:263, CHEBI:10940, CHEBI:18618
Supplier Information
Download Molfile XML SDF
Formula C18H30O3
Net Charge 0
Average Mass 294.42900
Monoisotopic Mass 294.21949
InChI InChI=1S/C18H30O3/c1-2-3-10-13-16-17(21-16)14-11-8-6-4-5-7-9-12-15-18(19)20/h8,11,14,16H,2-7,9-10,12-13,15H2,1H3,(H,19,20)/b11-8-,17-14-/t16-/m0/s1
InChIKey ZFVKKBAQVWQQHP-ALADIWIOSA-N
SMILES CCCCC[C@@H]1O\C1=C/C=C\CCCCCCCC(O)=O
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)-12,13-epoxyoctadeca-9,11-dienoic acid (CHEBI:15654) is a (13S)-12,13-epoxyoctadeca-9,11-dienoic acid (CHEBI:19135)
(9Z,13S)-12,13-epoxyoctadeca-9,11-dienoic acid (CHEBI:15654) is conjugate acid of (9Z,13S)-12,13-epoxyoctadeca-9,11-dienoate (CHEBI:57465)
Incoming (9Z,13S)-12,13-epoxyoctadeca-9,11-dienoate (CHEBI:57465) is conjugate base of (9Z,13S)-12,13-epoxyoctadeca-9,11-dienoic acid (CHEBI:15654)
IUPAC Name
(9Z)-11-[(3S)-3-pentyloxiran-2-ylidene]undec-9-enoic acid
Synonyms Sources
(9Z)-(13S)-12,13-Epoxyoctadeca-9,11-dienoate KEGG COMPOUND
(9Z)-(13S)-12,13-Epoxyoctadeca-9,11-dienoate KEGG COMPOUND
(9Z)-(13S)-12,13-Epoxyoctadeca-9,11-dienoic acid KEGG COMPOUND
13(S)-EOD KEGG COMPOUND
Manual Xrefs Databases
C04594 KEGG COMPOUND
LMFA01070015 LIPID MAPS
LMFA02000023 LIPID MAPS
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Last Modified
10 January 2019