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6,7-dihydroxycoumarin

C9H6O4 178.143 g/mol
H O H O O O
Name 6,7-dihydroxycoumarin
Alternative name 6,7-dihydroxycoumarin; Aesculetin
Formula C9H6O4
Formula Weight 178.14 g/mol
Molecular Weight 178.14 g/mol
Monoisotopic Mass 178.027000 g/mol
InChI Key ILEDWLMCKZNDJK-UHFFFAOYSA-N
IUPAC 6,7-dihydroxychromen-2-one
InChI InChI=1S/C9H6O4/c10-6-3-5-1-2-9(12)13-8(5)4-7(6)11/h1-4,10-11H
SMILES OC1=C(O)C=C2C=CC(=O)OC2=C1
Food Cocoa/chocolate, 
Food Source Cocoa, 
Family Phenolic
Class Coumarin
Subclass Group Dihydroxycoumarins
Subclass Hydroxycoumarin
Metabolite Coumarin derivative
CASNO 305-01-1
HMDB HMDB0030819
PubChem 5281416
KEGG C09263
FooDB FDB002775
DrugBank DB01904
ChEBI 490095
BioCyc CPD-1097
METLIN 5221.0