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CHEBI:212415 - O-methylmelleine

ChEBI IDCHEBI:212415
ChEBI NameO-methylmelleine
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC11H12O3
Net Charge0
Average Mass192.214
Monoisotopic Mass192.07864
SMILESCOc1cccc2c1C(=O)O[C@H](C)C2
InChIInChI=1S/C11H12O3/c1-7-6-8-4-3-5-9(13-2)10(8)11(12)14-7/h3-5,7H,6H2,1-2H3/t7-/m1/s1
InChIKeyAYIDXPPINFIJKW-SSDOTTSWSA-N
Species of MetaboliteComponentSourceComments
Parastagonospora nodorum (ncbitaxon:13684) - DOI (10.1016/s0031-9422(00)82234-7)
ChEBI Ontology
Outgoing Relation(s)
O-methylmelleine (CHEBI:212415) is a 2-benzopyran (CHEBI:38444)
IUPAC Name 
(3R)-8-methoxy-3-methyl-3,4-dihydroisochromen-1-one
Manual XrefsDatabases
808769ChemSpider