CHEBI:222858 - 6-hydroxy-3-hydroxymethyl-8-methoxyisocoumarin

ChEBI IDCHEBI:222858
ChEBI Name6-hydroxy-3-hydroxymethyl-8-methoxyisocoumarin
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SubmitterMetaboLights
DownloadsMolfile
FormulaC11H10O5
Net Charge0
Average Mass222.196
Monoisotopic Mass222.05282
SMILESCOc1cc(O)cc2cc(CO)oc(=O)c12
InChIInChI=1S/C11H10O5/c1-15-9-4-7(13)2-6-3-8(5-12)16-11(14)10(6)9/h2-4,12-13H,5H2,1H3
InChIKeyHPQZNWCJJRXDQE-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Graphis proserpens (ncbitaxon:996888) - PubMed (21612806)
ChEBI Ontology
Outgoing Relation(s)
6-hydroxy-3-hydroxymethyl-8-methoxyisocoumarin (CHEBI:222858) is a isocoumarins (CHEBI:38758)
IUPAC Name 
6-hydroxy-3-(hydroxymethyl)-8-methoxyisochromen-1-one
Manual XrefsDatabases
78435041ChemSpider