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CHEBI:202722 - (3S)-4,6-dihydro-8-methoxy-3,5-dimethyl-6-oxo-3H-2-benzopyran

ChEBI IDCHEBI:202722
ChEBI Name(3S)-4,6-dihydro-8-methoxy-3,5-dimethyl-6-oxo-3H-2-benzopyran
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC12H14O3
Net Charge0
Average Mass206.241
Monoisotopic Mass206.09429
SMILESCOC1=CC(=O)C(C)=C2C[C@H](C)OC=C12
InChIInChI=1S/C12H14O3/c1-7-4-9-8(2)11(13)5-12(14-3)10(9)6-15-7/h5-7H,4H2,1-3H3/t7-/m0/s1
InChIKeyOUKVSYNLCDYHEH-ZETCQYMHSA-N
Species of MetaboliteComponentSourceComments
Penicillium expansum (ncbitaxon:27334) - PubMed (15270557)
ChEBI Ontology
Outgoing Relation(s)
(3S)-4,6-dihydro-8-methoxy-3,5-dimethyl-6-oxo-3H-2-benzopyran (CHEBI:202722) is a benzopyran (CHEBI:22727)
IUPAC Name 
(3S)-8-methoxy-3,5-dimethyl-3,4-dihydroisochromen-6-one
Manual XrefsDatabases
9508157ChemSpider