CHEBI:17989 - daphnin

Main ChEBI Ontology Automatic Xrefs
ChEBI Name daphnin
ChEBI ID CHEBI:17989
Stars This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs CHEBI:23561, CHEBI:4322, CHEBI:14096
Supplier Information
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Formula C15H16O9
Net Charge 0
Average Mass 340.28214
InChI InChI=1S/C15H16O9/c16-5-8-10(18)12(20)13(21)15(23-8)22-7-3-1-6-2-4-9(17)24-14(6)11(7)19/h1-4,8,10,12-13,15-16,18-21H,5H2/t8-,10-,12+,13-,15-/m1/s1
InChIKey HOIXTKAYCMNVMY-PVOAASPHSA-N
SMILES OC[C@H]1O[C@@H](Oc2ccc3ccc(=O)oc3c2O)[C@H](O)[C@@H](O)[C@@H]1O
ChEBI Ontology
Outgoing daphnin (CHEBI:17989) has functional parent 7,8-dihydroxycoumarin (CHEBI:17313)
daphnin (CHEBI:17989) is a β-D-glucoside (CHEBI:22798)
IUPAC Name
7-(β-D-glucopyranosyloxy)-8-hydroxy-2H-chromen-2-one
Synonyms Sources
7-(β-D-glucopyranosyloxy)-8-hydroxycoumarin IUPAC
7-beta-D-glucopyranosyloxy-8-hydroxy-2H-1-benzopyran-2-one ChEBI
8-hydroxy-2-oxo-2H-chromen-7-yl β-D-glucopyranoside ChEBI
Daphnin KEGG COMPOUND
Database Link Database
C01421 KEGG COMPOUND
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Registry Number Type Source
486-55-5 CAS Registry Number KEGG COMPOUND
Last Modified
16 July 2008