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CHEBI:229038 - 8-Methyl-5-isopropyl-6,8-nonadiene-2-one

Default Structure
ChEBI IDCHEBI:229038
ChEBI Name8-Methyl-5-isopropyl-6,8-nonadiene-2-one
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC13H22O
Net Charge0
Average Mass194.318
Monoisotopic Mass194.16707
SMILESC=C(C)/C=C/C(CCC(C)=O)C(C)C
InChIInChI=1S/C13H22O/c1-10(2)6-8-13(11(3)4)9-7-12(5)14/h6,8,11,13H,1,7,9H2,2-5H3/b8-6+
InChIKeyPQDRXUSSKFWCFA-SOFGYWHQSA-N
Species of MetaboliteComponentSourceComments
Zea mays (ncbitaxon:4577) exometabolome MetaboLights (MTBLS8903)
ChEBI Ontology
Outgoing Relation(s)
8-Methyl-5-isopropyl-6,8-nonadiene-2-one (CHEBI:229038) is a ketone (CHEBI:17087)
IUPAC Name 
(6E)-8-methyl-5-propan-2-ylnona-6,8-dien-2-one
Manual XrefsDatabases
4477935ChemSpider
HMDB0032355HMDB