Terminology Service for NFDI4Health
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glycitein 4'-O-glucuronide

Go to external page http://purl.obolibrary.org/obo/CHEBI_133667

A glycosyloxyisoflavone that is the glucuronide-conjugated form of the phytoestrogen glycitein.

Term info

Label

glycitein 4'-O-glucuronide

Synonyms
  • 4-(7-hydroxy-6-methoxy-4-oxo-4H-1-benzopyran-3-yl)phenyl beta-D-glucopyranosiduronic acid
database cross reference
Subsets

3_STAR

IUPAC NAME
4-(7-hydroxy-6-methoxy-4-oxo-4H-1-benzopyran-3-yl)phenyl beta-D-glucopyranosiduronic acid [ IUPAC ]

charge

0

formula

C22H20O11

has obo namespace

chebi_ontology

has related synonym

glycitein 4'-O-beta-D-glucuronide, glycitein 4'-O-beta-glucuronide

id

CHEBI:133667

inchi

InChI=1S/C22H20O11/c1-30-15-6-11-14(7-13(15)23)31-8-12(16(11)24)9-2-4-10(5-3-9)32-22-19(27)17(25)18(26)20(33-22)21(28)29/h2-8,17-20,22-23,25-27H,1H3,(H,28,29)/t17-,18-,19+,20-,22+/m0/s1

inchikey

FXGSRMKCZRQRER-SXFAUFNYSA-N

mass

460.388

monoisotopicmass

460.10056

smiles

O(C1=C(C=C2OC=C(C(=O)C2=C1)C3=CC=C(O[C@@H]4O[C@@H]([C@@H](O)[C@H](O)[C@H]4O)C(O)=O)C=C3)O)C