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CHEBI:191438 - 1,3,5-Bisabolatrien-10-one

ChEBI IDCHEBI:191438
ChEBI Name1,3,5-Bisabolatrien-10-one
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC15H22O
Net Charge0
Average Mass218.340
Monoisotopic Mass218.16707
SMILESCc1ccc(C(C)CCC(=O)C(C)C)cc1
InChIInChI=1S/C15H22O/c1-11(2)15(16)10-7-13(4)14-8-5-12(3)6-9-14/h5-6,8-9,11,13H,7,10H2,1-4H3
InChIKeyUWAKTEDKARQVDV-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Solanum tuberosum (ncbitaxon:4113) leaf (BTO:0000713) MetaboLights (MTBLS4365)
ChEBI Ontology
Outgoing Relation(s)
1,3,5-Bisabolatrien-10-one (CHEBI:191438) is a sesquiterpenoid (CHEBI:26658)
IUPAC Name 
2-methyl-6-(4-methylphenyl)heptan-3-one
Manual XrefsDatabases
35014096ChemSpider
HMDB0036109HMDB