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biochanin A 7-O-beta-D-glucoside

Properties

Image

Occurences in reactions

MNX_ID

MNXM733181

	#reac
in my sandbox	0
in MNXref (generic)	6
in models (compartimentalized)	0

formula

C₂₂H₂₁O₁₀

charge

-1

mass

445.11402

reference

chebi:77804

InChIKey

LFEUICHQZGNOHD-RECXWPGBSA-M

InChI

InChI=1S/C22H22O10/c1-29-11-4-2-10(3-5-11)13-9-30-15-7-12(6-14(24)17(15)18(13)25)31-22-21(28)20(27)19(26)16(8-23)32-22/h2-7,9,16,19-24,26-28H,8H2,1H3/p-1/t16-,19-,20+,21-,22-/m1/s1

SMILES

COc1ccc(-c2coc3cc(O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)cc([O-])c3c2=O)cc1

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:77804 chebi:77804	biochanin A 7-O-beta-D-glucoside 7-(beta-D-glucopyranosyloxy)-3-(4-methoxyphenyl)-4-oxo-4H-chromen-5-olate biochanin A 7-O-beta-D-glucoside(1-)
kegg.compound:C05376 keggC:C05376	Biochanin A-beta-D-glucoside Biochanin A 7-O-beta-D-glucoside Sissotrin
seed.compound:cpd03184 seedM:cpd03184	Biochanin A-beta-D-glucoside Biochanin A 7-O-beta-D-glucoside Sissotrin biochanin A 7-O-beta-D-glucoside biochanin A-7-O-glucoside
CHEBI:28751 chebi:28751	biochanin A 7-O-beta-D-glucoside 5-hydroxy-3-(4-methoxyphenyl)-4-oxo-4H-chromen-7-yl beta-D-glucopyranoside Biochanin A 7-O-beta-D-glucoside Biochanin A-beta-D-glucoside Sissotrin sissotrin
metacyc.compound:CPD-4563 metacycM:CPD-4563	biochanin A-7-O-glucoside biochanin A 7-O-beta-D-glucoside
chebi:22877 chebi:3106 keggC:M_C05376 seedM:M_cpd03184	secondary/obsolete/fantasy identifier