CHEBI:210857 - 6,8-dimethoxy-3-hydroxymethylisocoumarin

ChEBI IDCHEBI:210857
ChEBI Name6,8-dimethoxy-3-hydroxymethylisocoumarin
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC12H12O5
Net Charge0
Average Mass236.223
Monoisotopic Mass236.06847
SMILESCOc1cc(OC)c2c(=O)oc(CO)cc2c1
InChIInChI=1S/C12H12O5/c1-15-8-3-7-4-9(6-13)17-12(14)11(7)10(5-8)16-2/h3-5,13H,6H2,1-2H3
InChIKeyRBFGVAMBNVZORR-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Phomopsis (ncbitaxon:34399) - DOI (10.1016/j.tet.2017.02.019)
ChEBI Ontology
Outgoing Relation(s)
6,8-dimethoxy-3-hydroxymethylisocoumarin (CHEBI:210857) is a isocoumarins (CHEBI:38758)
IUPAC Name 
3-(hydroxymethyl)-6,8-dimethoxyisochromen-1-one
Manual XrefsDatabases
9474301ChemSpider