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7-hydroxyisoflavone 7-O-beta-D-glucoside

Go to external page http://purl.obolibrary.org/obo/CHEBI_18174

A glycosyloxyisoflavone that is 7-hydroxyisoflavone attached to a beta-D-glucopyranosyl residue at position 7 via a glycosidic linkage.

Term info

Label

7-hydroxyisoflavone 7-O-beta-D-glucoside

Synonyms
  • 4-oxo-3-phenyl-4H-chromen-7-yl beta-D-glucopyranoside
database cross reference
Subsets

3_STAR

IUPAC NAME
4-oxo-3-phenyl-4H-chromen-7-yl beta-D-glucopyranoside [ IUPAC ]

charge

0

formula

C21H20O8

has alternative id

CHEBI:6014, CHEBI:24893, CHEBI:14468

has obo namespace

chebi_ontology

has related synonym

isoflavone 7-O-beta-D-glucoside, Isoflavone 7-O-beta-D-glucoside

id

CHEBI:18174

inchi

InChI=1S/C21H20O8/c22-9-16-18(24)19(25)20(26)21(29-16)28-12-6-7-13-15(8-12)27-10-14(17(13)23)11-4-2-1-3-5-11/h1-8,10,16,18-22,24-26H,9H2/t16-,18-,19+,20-,21-/m1/s1

inchikey

CHVBPFQVSIWBOU-QNDFHXLGSA-N

mass

400.37870

monoisotopicmass

400.11582

smiles

OC[C@H]1O[C@@H](Oc2ccc3c(c2)occ(-c2ccccc2)c3=O)[C@H](O)[C@@H](O)[C@@H]1O