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CHEBI:182006 - 3-(2,4-Dihydroxypentyl)-6,8-dimethoxyisochromen-1-one

ChEBI IDCHEBI:182006
ChEBI Name3-(2,4-Dihydroxypentyl)-6,8-dimethoxyisochromen-1-one
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC16H20O6
Net Charge0
Average Mass308.330
Monoisotopic Mass308.12599
SMILESCOc1cc(OC)c2c(=O)oc(CC(O)CC(C)O)cc2c1
InChIInChI=1S/C16H20O6/c1-9(17)4-11(18)7-13-6-10-5-12(20-2)8-14(21-3)15(10)16(19)22-13/h5-6,8-9,11,17-18H,4,7H2,1-3H3
InChIKeyUGHXSOJROIYABR-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
3-(2,4-Dihydroxypentyl)-6,8-dimethoxyisochromen-1-one (CHEBI:182006) is a isocoumarins (CHEBI:38758)
IUPAC Name 
3-(2,4-dihydroxypentyl)-6,8-dimethoxyisochromen-1-one
Manual XrefsDatabases
29814429ChemSpider