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552-66-9

552-66-9 structural image
Product Name: Daidzin
Formula: C21H20O9
Synonyms: 4′,7-Dihydroxyisoflavone 7-glucoside;Daidzein 7-glucoside;Daidzein-7-O-β-D-glucopyranoside;Daidzin
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description Solid
Melting Point 233 - 235 °C

SAFETY INFORMATION

Signal word Warning
Pictogram(s)

Exclamation Mark
Irritant
GHS07
GHS Hazard Statements H315:Skin corrosion/irritation
H319:Serious eye damage/eye irritation
H335:Specific target organ toxicity, single exposure;Respiratory tract irritation
Precautionary Statement Codes P261:Avoid breathing dust/fume/gas/mist/vapours/spray.
P271:Use only outdoors or in a well-ventilated area.
P280:Wear protective gloves/protective clothing/eye protection/face protection.

COMPUTED DESCRIPTORS

Molecular Weight 416.4 g/mol
XLogP3 0.7
Hydrogen Bond Donor Count 5
Hydrogen Bond Acceptor Count 9
Rotatable Bond Count 4
Exact Mass 416.11073221 g/mol
Monoisotopic Mass 416.11073221 g/mol
Topological Polar Surface Area 146 Ų
Heavy Atom Count 30
Formal Charge 0
Complexity 644
Isotope Atom Count 0
Defined Atom Stereocenter Count 5
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes

PRODUCT INTRODUCTION

description

Daidzein 7-O-beta-D-glucoside is a glycosyloxyisoflavone that is daidzein attached to a beta-D-glucopyranosyl residue at position 7 via a glycosidic linkage. It is used in the treatment of alcohol dependency (antidipsotropic). It has a role as a plant metabolite. It is a hydroxyisoflavone, a monosaccharide derivative and a 7-hydroxyisoflavones 7-O-beta-D-glucoside. It is functionally related to a daidzein.