CHEBI:32319 - α-ionone

ChEBI IDCHEBI:32319
ChEBI Nameα-ionone
Stars
ASCII Namealpha-ionone
Last Modified23 October 2015
DownloadsMolfile
FormulaC13H20O
Net Charge0
Average Mass192.302
Monoisotopic Mass192.15142
SMILESCC(=O)/C=C/C1C(C)=CCCC1(C)C
InChIInChI=1S/C13H20O/c1-10-6-5-9-13(3,4)12(10)8-7-11(2)14/h6-8,12H,5,9H2,1-4H3/b8-7+
InChIKeyUZFLPKAIBPNNCA-BQYQJAHWSA-N
Roles Classification
Biological Roles:
volatile oil component  Any plant metabolite that is found naturally as a component of a volatile oil.
plant metabolite  Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
ChEBI Ontology
Outgoing Relation(s)
α-ionone (CHEBI:32319) is a enone (CHEBI:51689)
α-ionone (CHEBI:32319) is a ionone (CHEBI:49248)
α-ionone (CHEBI:32319) is a methyl ketone (CHEBI:51867)
Incoming Relation(s)
3-hydroxy-α-ionone (CHEBI:67266) has functional parent α-ionone (CHEBI:32319)
α-irone (CHEBI:10284) has functional parent α-ionone (CHEBI:32319)
IUPAC Name 
(3E)-4-(2,6,6-trimethylcyclohex-2-en-1-yl)but-3-en-2-one
Synonyms  Source
alpha-IononeKEGG COMPOUND
alpha-cyclocitrylideneacetoneChemIDplus
α-(E)-iononeNIST Chemistry WebBook
(E)-α-IononeNIST Chemistry WebBook
trans-α-IononeNIST Chemistry WebBook
α-IononChEBI
Manual XrefsDatabases
C12286KEGG COMPOUND
Registry NumbersSources
Beilstein:2046085Beilstein
CAS:127-41-3KEGG COMPOUND
CAS:127-41-3ChemIDplus
CAS:127-41-3NIST Chemistry WebBook