EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:41 - (+)-piperitone

Default Structure
ChEBI IDCHEBI:41
ChEBI Name(+)-piperitone
Stars
DefinitionThe (6S)-enantiomer of piperitone.
Last Modified22 January 2015
DownloadsMolfile
FormulaC10H16O
Net Charge0
Average Mass152.237
Monoisotopic Mass152.12012
SMILESCC1=CC(=O)[C@H](C(C)C)CC1
InChIInChI=1S/C10H16O/c1-7(2)9-5-4-8(3)6-10(9)11/h6-7,9H,4-5H2,1-3H3/t9-/m0/s1
InChIKeyYSTPAHQEHQSRJD-VIFPVBQESA-N
Roles Classification
Biological Roles:
plant metabolite  Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
volatile oil component  Any plant metabolite that is found naturally as a component of a volatile oil.
ChEBI Ontology
Outgoing Relation(s)
(+)-piperitone (CHEBI:41) is a piperitone (CHEBI:48933)
(+)-piperitone (CHEBI:41) is enantiomer of (−)-piperitone (CHEBI:48934)
Incoming Relation(s)
(−)-piperitone (CHEBI:48934) is enantiomer of (+)-piperitone (CHEBI:41)
IUPAC Name 
(6S)-3-methyl-6-(propan-2-yl)cyclohex-2-en-1-one
Synonyms  Source
alpha-PiperitoneChemIDplus
d-PiperitoneKEGG COMPOUND
(S)-piperitoneChEBI
(+)-PiperitoneKEGG COMPOUND
(S)-3-methyl-6-(1-methylethyl)-2-cyclohexen-1-oneChemIDplus
Manual XrefsDatabases
C00003054KNApSAcK
C09885KEGG COMPOUND
LMPR0102090024LIPID MAPS
Registry NumbersSources
Reaxys:2042974Reaxys
CAS:6091-50-5KEGG COMPOUND
CAS:6091-50-5ChemIDplus