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CHEBI:168444 - Epishyobunone

ChEBI IDCHEBI:168444
ChEBI NameEpishyobunone
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC15H24O
Net Charge0
Average Mass220.356
Monoisotopic Mass220.18272
SMILESC=CC1(C)CCC(C(C)C)C(=O)C1C(=C)C
InChIInChI=1S/C15H24O/c1-7-15(6)9-8-12(10(2)3)14(16)13(15)11(4)5/h7,10,12-13H,1,4,8-9H2,2-3,5-6H3
InChIKeyGWHRSRIPLDHJHR-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Malus domestica (ncbitaxon:3750) exocarp (BTO:0000733) MetaboLights (MTBLS2384) Strain: Malus x domestica Borkh. cv. Ruixue
ChEBI Ontology
Outgoing Relation(s)
Epishyobunone (CHEBI:168444) is a sesquiterpenoid (CHEBI:26658)
IUPAC Name 
3-ethenyl-3-methyl-6-propan-2-yl-2-prop-1-en-2-ylcyclohexan-1-one
Manual XrefsDatabases
514038ChemSpider
HMDB0035306HMDB