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CHEBI:224264 - 6,8-dihydroxy-3-methoxy-3,7-dimethylisochromene-1,4-dione

ChEBI IDCHEBI:224264
ChEBI Name6,8-dihydroxy-3-methoxy-3,7-dimethylisochromene-1,4-dione
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC12H12O6
Net Charge0
Average Mass252.222
Monoisotopic Mass252.06339
SMILESCO[C@@]1(C)OC(=O)c2c(cc(O)c(C)c2O)C1=O
InChIInChI=1S/C12H12O6/c1-5-7(13)4-6-8(9(5)14)11(16)18-12(2,17-3)10(6)15/h4,13-14H,1-3H3/t12-/m0/s1
InChIKeyZIZIRWPNVKGOSB-LBPRGKRZSA-N
Species of MetaboliteComponentSourceComments
Aspergillus (ncbitaxon:5052) - PubMed (25996099)
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
6,8-dihydroxy-3-methoxy-3,7-dimethylisochromene-1,4-dione (CHEBI:224264) is a hydroxybenzoic acid (CHEBI:24676)
IUPAC Name 
6,8-dihydroxy-3-methoxy-3,7-dimethylisochromene-1,4-dione
Manual XrefsDatabases
35516991ChemSpider