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CHEBI:211739 - 6,8-dihydroxy-3-hydroxymethyl-5-methoxyisocoumarin

ChEBI IDCHEBI:211739
ChEBI Name6,8-dihydroxy-3-hydroxymethyl-5-methoxyisocoumarin
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC11H10O6
Net Charge0
Average Mass238.195
Monoisotopic Mass238.04774
SMILESCOc1c(O)cc(O)c2c(=O)oc(CO)cc12
InChIInChI=1S/C11H10O6/c1-16-10-6-2-5(4-12)17-11(15)9(6)7(13)3-8(10)14/h2-3,12-14H,4H2,1H3
InChIKeyOPHMCULGJJSHKH-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Conoideocrella (ncbitaxon:1105318) - DOI (10.1016/j.tet.2018.01.004)
ChEBI Ontology
Outgoing Relation(s)
6,8-dihydroxy-3-hydroxymethyl-5-methoxyisocoumarin (CHEBI:211739) is a isocoumarins (CHEBI:38758)
IUPAC Name 
6,8-dihydroxy-3-(hydroxymethyl)-5-methoxyisochromen-1-one
Manual XrefsDatabases
78435918ChemSpider