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CHEBI:171763 - 6-Hydroxy-4,6-dimethyl-3-hepten-2-one

ChEBI IDCHEBI:171763
ChEBI Name6-Hydroxy-4,6-dimethyl-3-hepten-2-one
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC9H16O2
Net Charge0
Average Mass156.225
Monoisotopic Mass156.11503
SMILESCC(=O)/C=C(/C)CC(C)(C)O
InChIInChI=1S/C9H16O2/c1-7(5-8(2)10)6-9(3,4)11/h5,11H,6H2,1-4H3/b7-5-
InChIKeyOAHJSCYHJQJALB-ALCCZGGFSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606)
blood plasma (BTO:0000131) MetaboLights (MTBLS2128)
Pooled sample (NCIT:C45910) MetaboLights (MTBLS2128)
ChEBI Ontology
Outgoing Relation(s)
6-Hydroxy-4,6-dimethyl-3-hepten-2-one (CHEBI:171763) is a tertiary alcohol (CHEBI:26878)
IUPAC Name 
(Z)-6-hydroxy-4,6-dimethylhept-3-en-2-one
Manual XrefsDatabases
9789953ChemSpider
HMDB0039736HMDB