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CHEBI:217943 - 5,6-dimethoxymellein

ChEBI IDCHEBI:217943
ChEBI Name5,6-dimethoxymellein
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC12H14O5
Net Charge0
Average Mass238.239
Monoisotopic Mass238.08412
SMILESCOc1cc(O)c2c(c1OC)C[C@H](C)OC2=O
InChIInChI=1S/C12H14O5/c1-6-4-7-10(12(14)17-6)8(13)5-9(15-2)11(7)16-3/h5-6,13H,4H2,1-3H3/t6-/m0/s1
InChIKeyGQDAQYCCKGXUJP-LURJTMIESA-N
Species of MetaboliteComponentSourceComments
Astrocystis (ncbitaxon:190942) - DOI (10.1016/j.tet.2014.02.004)
ChEBI Ontology
Outgoing Relation(s)
5,6-dimethoxymellein (CHEBI:217943) is a 2-benzopyran (CHEBI:38444)
IUPAC Name 
(3S)-8-hydroxy-5,6-dimethoxy-3-methyl-3,4-dihydroisochromen-1-one
Manual XrefsDatabases
32674850ChemSpider