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CHEBI:57411 - (15Z)-12-oxophyto-10,15-dienoate

ChEBI IDCHEBI:57411
ChEBI Name(15Z)-12-oxophyto-10,15-dienoate
Stars
ASCII Name(15Z)-12-oxophyto-10,15-dienoate
DefinitionConjugate base of (15Z)-12-oxophyto-10,15-dienoic acid.
Last Modified23 October 2024
DownloadsMolfile
FormulaC18H27O3
Net Charge-1
Average Mass291.411
Monoisotopic Mass291.19657
SMILESCC/C=C\C[C@@H]1C(=O)C=C[C@@H]1CCCCCCCC(=O)[O-]
InChIInChI=1S/C18H28O3/c1-2-3-7-11-16-15(13-14-17(16)19)10-8-5-4-6-9-12-18(20)21/h3,7,13-16H,2,4-6,8-12H2,1H3,(H,20,21)/p-1/b7-3-/t15-,16-/m0/s1
InChIKeyPMTMAFAPLCGXGK-JMTMCXQRSA-M
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
(15Z)-12-oxophyto-10,15-dienoate (CHEBI:57411) is a Jasmonate derivatives (CHEBI:167055)
(15Z)-12-oxophyto-10,15-dienoate (CHEBI:57411) is a oxo monocarboxylic acid anion (CHEBI:35902)
(15Z)-12-oxophyto-10,15-dienoate (CHEBI:57411) is conjugate base of (15Z)-12-oxophyto-10,15-dienoic acid (CHEBI:15560)
Incoming Relation(s)
(15Z)-12-oxophyto-10,15-dienoic acid (CHEBI:15560) is conjugate acid of (15Z)-12-oxophyto-10,15-dienoate (CHEBI:57411)
IUPAC Name 
8-{(1S,5S)-4-oxo-5-[(2Z)-pent-2-en-1-yl]cyclopent-2-en-1-yl}octanoate
UniProt Name  Source
(9S,13S,15Z)-12-oxophyto-10,15-dienoateUniProt