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CHEBI:49250 - γ-ionone

ChEBI IDCHEBI:49250
ChEBI Nameγ-ionone
Stars
ASCII Namegamma-ionone
Last Modified8 May 2008
SubmitterMarcus Ennis
DownloadsMolfile
FormulaC13H20O
Net Charge0
Average Mass192.302
Monoisotopic Mass192.15142
SMILESC=C1CCCC(C)(C)C1/C=C/C(C)=O
InChIInChI=1S/C13H20O/c1-10-6-5-9-13(3,4)12(10)8-7-11(2)14/h7-8,12H,1,5-6,9H2,2-4H3/b8-7+
InChIKeySFEOKXHPFMOVRM-BQYQJAHWSA-N
Roles Classification
Biological Roles:
plant metabolite  Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
volatile oil component  Any plant metabolite that is found naturally as a component of a volatile oil.
ChEBI Ontology
Outgoing Relation(s)
γ-ionone (CHEBI:49250) is a ionone (CHEBI:49248)
Incoming Relation(s)
(−)-γ-ionone (CHEBI:49251) is a γ-ionone (CHEBI:49250)
IUPAC Name 
(3E)-4-(2,2-dimethyl-6-methylidenecyclohexyl)but-3-en-2-one
Synonyms  Source
(3E)-4-(2,2-Dimethyl-6-methylenecyclohexyl)-3-buten-2-oneNIST Chemistry WebBook
γ-IononChEBI
Registry NumbersSources
Beilstein:1864436Beilstein
CAS:79-76-5ChemIDplus
CAS:79-76-5NIST Chemistry WebBook