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Daidzin

Daidzin structure

CAS No:
552-66-9
Formula:
C21H20O9
Chemical Name:
Daidzin
Synonyms:
4H-1-Benzopyran-4-one,7-(β-D-glucopyranosyloxy)-3-(4-hydroxyphenyl)-;Daidzin;7-(β-D-Glucopyranosyloxy)-3-(4-hydroxyphenyl)-4H-1-benzopyran-4-one;Daidzein 7-glucoside;7,4′-Dihydroxyisoflavone 7-glucoside;Daidzoside;Daidzein 7-O-glucoside;NPI 031D;Daidzine;1329-08-4;28572-56-7
Categories:
Biochemical Engineering > Biosynthetic Natural Products

Description

Daidzin is an isoflavone that has anti-oxidant, anti-carcinogenic, and anti-atherosclerotic activities; directly inhibits mitochondrial aldehyde dehydrogenase 2 (IC50 = 80 nM) and is an effective anti-dipsotropic isoflavone.

Solid

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 derives from a daidzein.

Daidzin Basic Attributes

Molecular Weight：

416.38

Exact Mass：

416.38

UNII：

4R2X91A5M5

HScode：

29389090

Characteristics

PSA：

146

XLogP3：

0.7

Appearance：

Solid

Density：

1.6±0.1 g/cm3

Melting Point：

215-217 °C (decomp)

Boiling Point：

727.6±60.0°C at 760 mmHg

Flash Point：

259.8±26.4 °C

Refractive Index：

1.695

Storage Conditions：

Refrigerator

Specific rotation：

-24 º (C=0.1g/100ml,dimethylsulfoxide)

Safety Information

Transport codes：

NONH for all modes of transport

wgk germany：

safety instructions：

24/25

RTECS Number：

DJ3094000

Precautionary statement(s)：

P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, P501

Hazard Statements：

H315

GHS Classification：

|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 2 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Drug Information

MeSH：

Substances interfering with the metabolism of ethyl alcohol, causing unpleasant side effects thought to discourage the drinking of alcoholic beverages. Alcohol deterrents are used in the treatment of alcoholism. (See all compounds classified as Alcohol Deterrents.)|Compounds or agents that combine with an enzyme in such a manner as to prevent the normal substrate-enzyme combination and the catalytic reaction. (See all compounds classified as Enzyme Inhibitors.)

MeSH Entry Terms：

7-O-glucosyl-4'-hydroxyisoflavone

Daidzin Use and Manufacturing

A metabolite of isoflavone derivatives.

Computed Properties

Molecular Weight:416.4
XLogP3:0.7
Hydrogen Bond Donor Count:5
Hydrogen Bond Acceptor Count:9
Rotatable Bond Count:4
Exact Mass:416.11073221
Monoisotopic Mass:416.11073221
Topological Polar Surface Area:146
Heavy Atom Count:30
Complexity:644
Defined Atom Stereocenter Count:5
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of Daidzin

Description
Basic Attributes
Characteristics
Safety Information
Drug Information
Use and Manufacturing
Computed Properties
Recommended Suppliers
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Daidzin

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