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CHEBI:226126 - 6,7-dihydroxy-3-methoxy-3-methylphthalide

ChEBI IDCHEBI:226126
ChEBI Name6,7-dihydroxy-3-methoxy-3-methylphthalide
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC10H10O5
Net Charge0
Average Mass210.185
Monoisotopic Mass210.05282
SMILESCO[C@@]1(C)OC(=O)c2c1ccc(O)c2O
InChIInChI=1S/C10H10O5/c1-10(14-2)5-3-4-6(11)8(12)7(5)9(13)15-10/h3-4,11-12H,1-2H3/t10-/m0/s1
InChIKeyPPHNVRIRVQMSHS-JTQLQIEISA-N
Species of MetaboliteComponentSourceComments
Penicillium (ncbitaxon:5073) - PubMed (23792827)
ChEBI Ontology
Outgoing Relation(s)
6,7-dihydroxy-3-methoxy-3-methylphthalide (CHEBI:226126) is a benzofurans (CHEBI:35259)
IUPAC Name 
(3S)-6,7-dihydroxy-3-methoxy-3-methyl-2-benzouran-1-one
Manual XrefsDatabases
30770807ChemSpider