3-(4-Hydroxyphenyl)-4-oxo-4H-chromen-7-yl 4-O-methyl-beta-D-glucopyranoside

Basic Information

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CAS Number

1195968-02-5

Molecular Formula

C22H22O9

Molecular Weight

430.41 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Ethers

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Surfactants Anionic Surfactants

Laboratory Chemicals Research Chemicals Biochemical Reagents

Basic Physical Properties

Physical State

Powder

Boiling Point

708.1±60.0 °C at 760 mmHg

Flash Point

249.6±26.4 °C

Vapor Pressure

0.0±2.4 mmHg at 25°C

SMILES

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CO[C@@H]1[C@H](O[C@H]([C@@H]([C@H]1O)O)Oc2ccc3c(c2)occ(c3=O)c4ccc(cc4)O)CO

InChI

InChI=1S/C22H22O9/c1-28-21-17(9-23)31-22(20(27)19(21)26)30-13-6-7-14-16(8-13)29-10-15(18(14)25)11-2-4-12(24)5-3-11/h2-8,10,17,19-24,26-27H,9H2,1H3/t17-,19-,20-,21-,22-/m1/s1

InChIKey

BVKFFAQGFXJQBI-MSEOUXRUSA-N

LogP

0.9983999999999995

Topological Polar Surface Area

138.82000000000002 Å²

Hydrogen Bond Donor/Acceptor

4 / 9

Complexity

659

Safety Information

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Storage Conditions

2-8℃

Synonyms & References

English

Daidzein 7-O-beta-D-glucoside 4''-O-methylate
4''-methyloxy-Daidzin
7-[(2S,3R,4R,5S,6R)-3,4-dihydroxy-6-(hydroxymethyl)-5-methoxyoxan-2-yl]oxy-3-(4-hydroxyphenyl)chromen-4-one
7-[3,4-Dihydroxy-6-(hydroxymethyl)-5-methoxyoxan-2-yl]oxy-3-(4-hydroxyphenyl)chromen-4-one
4'-Hydroxy-7-(4-O-methyl-beta-D-glucopyranosyloxy)isoflavone
Daidzein 7-O-Β-D-glucoside 4''-O-methylate

MDL Number

MFCD22375471

FAQ

What is 3-(4-Hydroxyphenyl)-4-oxo-4H-chromen-7-yl 4-O-methyl-beta-D-glucopyranoside (CAS: 1195968-02-5)?

3-(4-Hydroxyphenyl)-4-oxo-4H-chromen-7-yl 4-O-methyl-beta-D-glucopyranoside (CAS: 1195968-02-5) is a chromone glycoside with a hydroxyl group and a methylated glucose moiety. It is typically used in pharmaceutical research for its antioxidant and anti-inflammatory properties.

What are the main uses of 3-(4-Hydroxyphenyl)-4-oxo-4H-chromen-7-yl 4-O-methyl-beta-D-glucopyranoside (CAS: 1195968-02-5)?

This compound is primarily used in pharmaceutical research to investigate its antioxidant and anti-inflammatory effects. It may also be explored for use in dietary supplements and functional foods.

Is 3-(4-Hydroxyphenyl)-4-oxo-4H-chromen-7-yl 4-O-methyl-beta-D-glucopyranoside (CAS: 1195968-02-5) safe?

While generally considered safe, this compound should be handled with care. It is important to follow all safety guidelines, wear appropriate personal protective equipment, and ensure proper ventilation during handling and use.

How should 3-(4-Hydroxyphenyl)-4-oxo-4H-chromen-7-yl 4-O-methyl-beta-D-glucopyranoside (CAS: 1195968-02-5) be stored?

It should be stored in a cool, dry place away from direct sunlight and heat sources. Store in a tightly sealed container to protect from moisture and contaminants. Avoid contact with incompatible materials and keep the compound out of reach of children and unauthorized personnel.