(1S)-1,5-Anhydro-2-O-(6-deoxy-beta-D-mannopyranosyl)-1-[5,7-dihydroxy-2-(4-hydroxyphenyl)-4-oxo-4H-chromen-8-yl]-D-glucitol

Basic Information

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CAS Number

64820-99-1

Molecular Formula

C27H30O14

Molecular Weight

578.52 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

Yellow powder

Melting Point

209-219°C

Boiling Point

898.8℃/760mmHg

Density

1.7400

Flash Point

299.4 °C

Solubility

Methanol

Refractive Index

1.751

SMILES

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C[C@@H]1[C@H]([C@@H]([C@@H]([C@@H](O1)O[C@H]2[C@@H](O[C@@H]([C@H]([C@@H]2O)O)CO)c3c(cc(c4c3oc(cc4=O)c5ccc(cc5)O)O)O)O)O)O

InChI

InChI=1S/C27H30O14/c1-9-19(33)21(35)23(37)27(38-9)41-26-22(36)20(34)16(8-28)40-25(26)18-13(31)6-12(30)17-14(32)7-15(39-24(17)18)10-2-4-11(29)5-3-10/h2-7,9,16,19-23,25-31,33-37H,8H2,1H3/t9-,16-,19-,20-,21+,22+,23+,25+,26-,27+/m1/s1

InChIKey

LYGPBZVKGHHTIE-NQQFNCMQSA-N

LogP

-1.0565

Topological Polar Surface Area

239.96999999999994 Å²

Hydrogen Bond Donor/Acceptor

9 / 14

Complexity

954

Safety Information

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Hazard Statement

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

H335 May cause respiratory irritation
Specific target organ toxicity, single exposure; Respiratory tract irritation

Storage Conditions

2-8℃

Synonyms & References

English

Vitexin-2-O-rhamnoside
2-O-Rhamnosylvitexin
vitexin-2″-o-rhamnoside
2''-O-Rhamnosylvitexin
4H-1-Benzopyran-4-one,8-[2-O-(6-deoxy-a-L-mannopyranosyl)-b-D-glucopyranosyl]-5,7-dihydroxy-2-(4-hydroxyphenyl)-
8-[(2S,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]-5,7-dihydroxy-2-(4-hydroxyphenyl)chromen-4-one
Rhamnosylvitexin
Vitexin 2-O-rhamnoside
Vitexin-2''-O-rhamnoside
VITEXIN-2''-O-RHAMNOSIDE(RG) PrintBack
2"-Rhamnosylvitexin
vitexin 2''-O-alpha-L-rhamnoside
Vitexin-2"-O-rhamnoside
vitexin-2 inverted exclamation marka-o-rhamnoside
Vitexin-2-rhamnoside
(?)-N-Boc-N,O-isopropylidene-L-serinal
AK554508
(S)-(?)-3-Boc-2,2-dimethyloxazolidine-4-carboxaldehyde
8-[4,5-dihydroxy-6-(hydroxymethyl)-3-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxyoxan-2-yl]-5,7-dihydroxy-2-(4-hydroxyphenyl)chromen-4-one
Vitexin 2''-O-rhamnoside,Vitexin 2''-rhamnoside

MDL Number

MFCD29913069

FAQ

What is (1S)-1,5-Anhydro-2-O-(6-deoxy-beta-D-mannopyranosyl)-1-[5,7-dihydroxy-2-(4-hydroxyphenyl)-4-oxo-4H-chromen-8-yl]-D-glucitol (CAS: 64820-99-1)?

This compound is a complex glycosylated derivative of D-glucitol, featuring a glucose unit linked to a chromone ring. It is a white to beige solid with high molecular weight, and is known for its structural complexity and potential biological activity. Its chemical formula is C21H24O12, and it exhibits solubility in polar solvents due to its hydroxyl groups.

What are the main uses of (1S)-1,5-Anhydro-2-O-(6-deoxy-beta-D-mannopyranosyl)-1-[5,7-dihydroxy-2-(4-hydroxyphenyl)-4-oxo-4H-chromen-8-yl]-D-glucitol (CAS: 64820-99-1)?

This compound is primarily used in pharmaceutical research as a potential drug candidate, particularly in the development of anti-diabetic and anti-inflammatory agents. It also finds applications in biochemical studies and may be utilized in the synthesis of more complex molecules with therapeutic value.

Is (1S)-1,5-Anhydro-2-O-(6-deoxy-beta-D-mannopyranosyl)-1-[5,7-dihydroxy-2-(4-hydroxyphenyl)-4-oxo-4H-chromen-8-yl]-D-glucitol (CAS: 64820-99-1) safe?

Safety data for this compound is limited, but as a chemical substance, it should be handled with care. Protective measures such as gloves and goggles are recommended during handling. It is advisable to follow standard safety protocols for handling organic compounds and consult safety data sheets for detailed information.

How should (1S)-1,5-Anhydro-2-O-(6-deoxy-beta-D-mannopyranosyl)-1-[5,7-dihydroxy-2-(4-hydroxyphenyl)-4-oxo-4H-chromen-8-yl]-D-glucitol (CAS: 64820-99-1) be stored?

This compound should be stored in a cool, dry, and dark place to maintain stability. It is recommended to keep it in a sealed container away from moisture and light. Storage at temperatures below 25°C and in a controlled humidity environment ensures optimal preservation and prevents degradation.