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CHEBI:192930 - 13-keto-9Z,11E,15Z-octadecatrienoic acid

ChEBI IDCHEBI:192930
ChEBI Name13-keto-9Z,11E,15Z-octadecatrienoic acid
Stars
Last Modified8 September 2022
SubmitterMetaboLights
DownloadsMolfile
FormulaC18H28O3
Net Charge0
Average Mass292.419
Monoisotopic Mass292.20384
SMILESCC/C=C\CC(=O)/C=C/C=C\CCCCCCCC(=O)O
InChIInChI=1S/C18H28O3/c1-2-3-11-14-17(19)15-12-9-7-5-4-6-8-10-13-16-18(20)21/h3,7,9,11-12,15H,2,4-6,8,10,13-14,16H2,1H3,(H,20,21)/b9-7-,11-3-,15-12+
InChIKeyBNMYUQILBYIYOG-JDTPQGGVSA-N
Species of MetaboliteComponentSourceComments
Cryptomeria (ncbitaxon:3368) needle (BTO:0000917) MetaboLights (MTBLS3183) Strain: Cryptomeria fortunei Hooibrenk
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
13-keto-9Z,11E,15Z-octadecatrienoic acid (CHEBI:192930) is a octadecatrienoic acid (CHEBI:25633)
13-keto-9Z,11E,15Z-octadecatrienoic acid (CHEBI:192930) is a oxo monocarboxylic acid (CHEBI:35871)
IUPAC Name 
(9Z,11E,15Z)-13-oxooctadeca-9,11,15-trienoic acid
Manual XrefsDatabases
9601226ChemSpider
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