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dihydrogenistin

Properties

Image

Occurences in reactions

MNX_ID

MNXM124919

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

formula

C₂₁H₂₂O₁₀

charge

mass

434.1213

reference

chebi:133413

InChIKey

HZFUHKPAKUYSOB-KENFSNRMSA-N

InChI

InChI=1S/C21H22O10/c22-7-15-18(26)19(27)20(28)21(31-15)30-11-5-13(24)16-14(6-11)29-8-12(17(16)25)9-1-3-10(23)4-2-9/h1-6,12,15,18-24,26-28H,7-8H2/t12?,15-,18-,19+,20-,21-/m1/s1

SMILES

O=C1c2c(O)cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc2OCC1c1ccc(O)cc1

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:133413 chebi:133413	dihydrogenistin 5,7,4'-Trihydroxyisoflavanone 7-O-glucoside 5-hydroxy-3-(4-hydroxyphenyl)-4-oxo-3,4-dihydro-2H-1-benzopyran-7-yl beta-D-glucopyranoside dihydrogenistein 7-O-beta-D-glucopyranoside dihydrogenistein 7-O-beta-D-glucoside
hmdb:HMDB0039935	Dihydrogenistin 5,7,4'-Trihydroxyisoflavanone 7-O-glucoside 5-hydroxy-3-(4-hydroxyphenyl)-7-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-2,3-dihydro-1-benzopyran-4-one 5-hydroxy-3-(4-hydroxyphenyl)-7-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-3,4-dihydro-2H-1-benzopyran-4-one
hmdb:HMDB39935	secondary/obsolete/fantasy identifier