CHEBI:17313 - 7,8-dihydroxycoumarin

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 7,8-dihydroxycoumarin
ChEBI ID CHEBI:17313
Stars This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs CHEBI:12246, CHEBI:2252, CHEBI:20770
Supplier Information
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Formulae C9H6O4
C9H6O4
Net Charge 0
Average Mass 178.142
Monoisotopic Mass 178.02661
InChI InChI=1S/C9H6O4/c10-6-3-1-5-2-4-7(11)13-9(5)8(6)12/h1-4,10,12H
InChIKey ATEFPOUAMCWAQS-UHFFFAOYSA-N
SMILES C12=C(C=CC(=C1O)O)C=CC(O2)=O
ChEBI Ontology
Outgoing 7,8-dihydroxycoumarin (CHEBI:17313) is a hydroxycoumarin (CHEBI:37912)
Incoming 7-hydroxy-8-methoxycoumarin (CHEBI:180544) has functional parent 7,8-dihydroxycoumarin (CHEBI:17313)
daphnin (CHEBI:17989) has functional parent 7,8-dihydroxycoumarin (CHEBI:17313)
IUPAC Name
7,8-dihydroxy-2H-chromen-2-one
Synonyms Sources
7,8-Dihydroxy-2H-1-benzopyran-2-one ChemIDplus
7,8-Dihydroxycoumarin KEGG COMPOUND
7,8-dihydroxycoumarin UniProt
Daphnetin KEGG COMPOUND
Daphnetol ChemIDplus
Manual Xrefs Databases
C00002462 KNApSAcK
C03093 KEGG COMPOUND
LSM-3366 LINCS
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Registry Number Type Source
486-35-1 CAS Registry Number KEGG COMPOUND
Last Modified
13 November 2017