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CHEBI:136633 - (9Z,11Z,13S,15Z)-12,13-epoxyoctadecatrienoic acid

ChEBI IDCHEBI:136633
ChEBI Name(9Z,11Z,13S,15Z)-12,13-epoxyoctadecatrienoic acid
Stars
ASCII Name(9Z,11Z,13S,15Z)-12,13-epoxyoctadecatrienoic acid
DefinitionAn octadecanoid that is (9Z,11Z,15Z)-octadecatrienoic acid having an epoxy group located across positions 12 and 13.
Last Modified22 March 2017
SubmitterSteve
DownloadsMolfile
FormulaC18H28O3
Net Charge0
Average Mass292.419
Monoisotopic Mass292.20384
SMILESCC/C=C\C[C@@H]1O/C1=C\C=C/CCCCCCCC(=O)O
InChIInChI=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
InChIKeyYZBZORUZOSCZRN-DCUPSMFCSA-N
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
(9Z,11Z,13S,15Z)-12,13-epoxyoctadecatrienoic acid (CHEBI:136633) is a epoxy fatty acid (CHEBI:61498)
(9Z,11Z,13S,15Z)-12,13-epoxyoctadecatrienoic acid (CHEBI:136633) is a long-chain fatty acid (CHEBI:15904)
(9Z,11Z,13S,15Z)-12,13-epoxyoctadecatrienoic acid (CHEBI:136633) is a octadecanoid (CHEBI:36326)
(9Z,11Z,13S,15Z)-12,13-epoxyoctadecatrienoic acid (CHEBI:136633) is a polyunsaturated fatty acid (CHEBI:26208)
(9Z,11Z,13S,15Z)-12,13-epoxyoctadecatrienoic acid (CHEBI:136633) is conjugate acid of (9Z,11Z,13S,15Z)-12,13-epoxyoctadecatrienoate (CHEBI:134055)
Incoming Relation(s)
(9Z,11Z,13S,15Z)-12,13-epoxyoctadecatrienoate (CHEBI:134055) is conjugate base of (9Z,11Z,13S,15Z)-12,13-epoxyoctadecatrienoic acid (CHEBI:136633)
IUPAC Name 
(9Z,11Z)-11-{(3S)-3-[(2Z)-pent-2-en-1-yl]oxiran-2-ylidene}undec-9-enoic acid