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CHEBI:168016 - 7-(1,3-Cyclohexadienyl)-5-hydroxy-2,6-dimethyl-2-hepten-4-one

ChEBI IDCHEBI:168016
ChEBI Name7-(1,3-Cyclohexadienyl)-5-hydroxy-2,6-dimethyl-2-hepten-4-one
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC15H22O2
Net Charge0
Average Mass234.339
Monoisotopic Mass234.16198
SMILESCC(C)=CC(=O)C(O)C(C)CC1=CC=CCC1
InChIInChI=1S/C15H22O2/c1-11(2)9-14(16)15(17)12(3)10-13-7-5-4-6-8-13/h4-5,7,9,12,15,17H,6,8,10H2,1-3H3
InChIKeyZKNLFTOBEMGDRP-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)
7-(1,3-Cyclohexadienyl)-5-hydroxy-2,6-dimethyl-2-hepten-4-one (CHEBI:168016) is a monosaccharide (CHEBI:35381)
IUPAC Name 
7-cyclohexa-1,3-dien-1-yl-5-hydroxy-2,6-dimethylhept-2-en-4-one
Manual XrefsDatabases
HMDB0037739HMDB
35014461ChemSpider