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CHEBI:214001 - Leptosphaerone C

ChEBI IDCHEBI:214001
ChEBI NameLeptosphaerone C
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC8H12O3
Net Charge0
Average Mass156.181
Monoisotopic Mass156.07864
SMILESCC1=CC(=O)[C@@](C)(O)[C@H](O)C1
InChIInChI=1S/C8H12O3/c1-5-3-6(9)8(2,11)7(10)4-5/h3,7,10-11H,4H2,1-2H3/t7-,8-/m1/s1
InChIKeyJPANATRWCFTRDD-HTQZYQBOSA-N
Species of MetaboliteComponentSourceComments
Penicillium (ncbitaxon:5073) - PubMed (18067932)
ChEBI Ontology
Outgoing Relation(s)
Leptosphaerone C (CHEBI:214001) is a cyclohexenones (CHEBI:48953)
IUPAC Name 
(5R,6S)-5,6-dihydroxy-3,6-dimethylcyclohex-2-en-1-one
Manual XrefsDatabases
27023666ChemSpider