CHEBI:50042 - α-thujone

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ChEBI Name α-thujone
ChEBI ID CHEBI:50042
ChEBI ASCII Name alpha-thujone
Definition The rel-(1R,4S,5S)-stereoisomer of thujone.
Stars This entity has been manually annotated by the ChEBI Team.
Formula C10H16O
Net Charge 0
Average Mass 152.234
Monoisotopic Mass 152.12012
Roles Classification
Biological Role(s): plant metabolite
Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
(via thujone )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing α-thujone (CHEBI:50042) is a thujone (CHEBI:50040)
Incoming (−)-α-thujone (CHEBI:9577) is a α-thujone (CHEBI:50042)
(+)-α-thujone (CHEBI:50043) is a α-thujone (CHEBI:50042)
IUPAC Names
rel-(1R,4S,5S)-4-methyl-1-(propan-2-yl)bicyclo[3.1.0]hexan-3-one
rel-(1R,4S,5S)-thujan-3-one
Synonym Source
rel-(1R,4S,5S)-1-isopropyl-4-methylbicyclo[3.1.0]hexan-3-one IUPAC
Registry Number Type Source
3934892 Beilstein Registry Number Beilstein
Last Modified
19 March 2014