CHEBI:42202 - daidzein 7-O-β-D-glucoside

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ChEBI Name daidzein 7-O-β-D-glucoside
ChEBI ID CHEBI:42202
ChEBI ASCII Name daidzein 7-O-beta-D-glucoside
Definition A glycosyloxyisoflavone that is daidzein attached to a β-D-glucopyranosyl residue at position 7 via a glycosidic linkage. It is used in the treatment of alcohol dependency (antidipsotropic).
Stars This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs CHEBI:42197, CHEBI:4307, CHEBI:86150
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Formula C21H20O9
Net Charge 0
Average Mass 416.37810
Monoisotopic Mass 416.11073
InChI InChI=1S/C21H20O9/c22-8-16-18(25)19(26)20(27)21(30-16)29-12-5-6-13-15(7-12)28-9-14(17(13)24)10-1-3-11(23)4-2-10/h1-7,9,16,18-23,25-27H,8H2/t16-,18-,19+,20-,21-/m1/s1
InChIKey KYQZWONCHDNPDP-QNDFHXLGSA-N
SMILES OC[C@H]1O[C@@H](Oc2ccc3c(c2)occ(-c2ccc(O)cc2)c3=O)[C@H](O)[C@@H](O)[C@@H]1O
Metabolite of Species Details
Glycine max (NCBI:txid3847) See: PubMed
Roles Classification
Biological Role(s): plant metabolite
Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
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ChEBI Ontology
Outgoing daidzein 7-O-β-D-glucoside (CHEBI:42202) has functional parent daidzein (CHEBI:28197)
daidzein 7-O-β-D-glucoside (CHEBI:42202) has role plant metabolite (CHEBI:76924)
daidzein 7-O-β-D-glucoside (CHEBI:42202) is a 7-hydroxyisoflavones 7-O-β-D-glucoside (CHEBI:140301)
daidzein 7-O-β-D-glucoside (CHEBI:42202) is a hydroxyisoflavone (CHEBI:38755)
daidzein 7-O-β-D-glucoside (CHEBI:42202) is a monosaccharide derivative (CHEBI:63367)
Incoming malonyldaidzin (CHEBI:80371) has functional parent daidzein 7-O-β-D-glucoside (CHEBI:42202)
IUPAC Names
3-(4-hydroxyphenyl)-4-oxo-4H-1-benzopyran-7-yl β-D-glucopyranoside
7-(β-D-glucopyranosyloxy)-3-(4-hydroxyphenyl)-4H-chromen-4-one
Synonyms Sources
daidzein 7-glucoside ChemIDplus
daidzein 7-O-β-D-glucoside UniProt
daidzein 7-O-glucoside ChemIDplus
Daidzein 7-O-glucoside KEGG COMPOUND
Daidzin KEGG COMPOUND
DAIDZIN PDBeChem
daidzoside ChemIDplus
Manual Xrefs Databases
C00002518 KNApSAcK
C10216 KEGG COMPOUND
CPD-3424 MetaCyc
Daidzin Wikipedia
DB02115 DrugBank
DZN PDBeChem
HMDB0033991 HMDB
LMPK12050013 LIPID MAPS
View more database links
Registry Numbers Types Sources
552-66-9 CAS Registry Number ChemIDplus
59741 Reaxys Registry Number Reaxys
59741 Beilstein Registry Number Beilstein
Citations Waiting for Citations Types Sources
18613661 PubMed citation Europe PMC
24154619 PubMed citation Europe PMC
24483603 PubMed citation Europe PMC
25209298 PubMed citation Europe PMC
25236207 PubMed citation Europe PMC
25746576 PubMed citation Europe PMC
25845411 PubMed citation Europe PMC
8433985 PubMed citation Europe PMC
Last Modified
03 March 2018