3,5-Dihydroxy-4-[3-(4-hydroxyphenyl)propanoyl]phenyl 2-O-(6-deoxy-alpha-L-mannopyranosyl)-beta-L-glucopyranoside

Basic Information

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CAS Number

18916-17-1

Molecular Formula

C27H34O14

Molecular Weight

582.56 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Ketones

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

Melting Point

131-132 ºC

Boiling Point

916.8 ºC at 760 mmHg

Density

1.63

Flash Point

302.7 ºC

Solubility

Soluble in DMSO

Refractive Index

1.696

SMILES

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CC1C(C(C(C(O1)OC2C(C(C(OC2OC3=CC(=C(C(=C3)O)C(=O)CCC4=CC=C(C=C4)O)O)CO)O)O)O)O)O

InChI

InChI=1S/C27H34O14/c1-11-20(33)22(35)24(37)26(38-11)41-25-23(36)21(34)18(10-28)40-27(25)39-14-8-16(31)19(17(32)9-14)15(30)7-4-12-2-5-13(29)6-3-12/h2-3,5-6,8-9,11,18,20-29,31-37H,4,7,10H2,1H3/t11-,18-,20-,21-,22+,23+,24+,25-,26-,27-/m0/s1

InChIKey

CWBZAESOUBENAP-IKACCGSXSA-N

LogP

-1.3506000000000007

Topological Polar Surface Area

236.05999999999995 Å²

Hydrogen Bond Donor/Acceptor

9 / 14

Complexity

827

Safety Information

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Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral

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

7233QDO0QW
UNII-7233QDO0QW
W-201689
NCGC00346603-02
DTXSID10940428
1-Propanone, 1-(4-((2-O-(6-deoxy-alpha-L-mannopyranosyl)-beta-D-glucopyranosyl)oxy)-2,6-dihydroxyphenyl)-3-(4-hydroxyphenyl)-
CHEBI:184078
MFCD08436145
FEMA no. 4495
HY-N0119
CCG-270138
AS-12149
GLUCOPYRANOSIDE, 3,5-DIHYDROXY-4-(P-HYDROXYHYDROCINNAMOYL)PHENYL 2-O-(6-DEOXY-.ALPHA.-L-MANNOPYRANOSYL)-, .BETA.-D-
1-PROPANONE, 1-(4-((2-O-(6-DEOXY-.ALPHA.-L-MANNOPYRANOSYL)-.BETA.-D-GLUCOPYRANOSYL)OXY)-2,6-DIHYDROXYPHENYL)-3-(4-HYDROXYPHENYL)-
Naringin DC
SCHEMBL3119273
AKOS022168204
Glucopyranoside, 3,5-dihydroxy-4-(p-hydroxyhydrocinnamoyl)phenyl 2-O-(6-deoxy-alpha-L-mannopyranosyl)-, beta-D-
1-[4-[(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]oxy-2,6-dihydroxyphenyl]-3-(4-hydroxyphenyl)propan-1-one
s2389
PHLORETIN, 4'-(2-O-.ALPHA.-L-RHAMNO-.BETA.-D-GLUCOPYRANOSIDE)
CWBZAESOUBENAP-QVNVHUMTSA-N
naringin dihydrochalcone, AldrichCPR
Naringin Dihydrochalcone (Naringin DC)
naringin-dihydrochalcone
EC 700-320-7
1-Propanone, 1-[4-[[2-O-(6-deoxy-alpha-L-mannopyranosyl)-beta-D-glucopyranosyl]oxy]-2,6-dihydroxyphenyl]-3-(4-hydroxyphenyl)-
1ST40286
Phloretin, 4'-(2-O-alpha-L-rhamno-beta-D-glucopyranoside)
naringin dihydrochalcone
CS-6414

MDL Number

MFCD00798060

FAQ

What is 3,5-Dihydroxy-4-[3-(4-hydroxyphenyl)propanoyl]phenyl 2-O-(6-deoxy-alpha-L-mannopyranosyl)-beta-L-glucopyranoside (CAS: 18916-17-1)?

3,5-Dihydroxy-4-[3-(4-hydroxyphenyl)propanoyl]phenyl 2-O-(6-deoxy-alpha-L-mannopyranosyl)-beta-L-glucopyranoside (CAS: 18916-17-1) is a complex glycoside compound containing a beta-L-glucopyranoside and a 6-deoxy-alpha-L-mannopyranosyl group. It is characterized by its hydroxyl and ester functionalities, which contribute to its solubility and reactivity. This compound is commonly used in biochemical research and pharmaceutical development due to its structural complexity and potential biological activity.

What are the main uses of 3,5-Dihydroxy-4-[3-(4-hydroxyphenyl)propanoyl]phenyl 2-O-(6-deoxy-alpha-L-mannopyranosyl)-beta-L-glucopyranoside (CAS: 18916-17-1)?

This compound is primarily used in pharmaceutical research for the development of drugs targeting metabolic disorders and inflammatory conditions. It also finds applications in biochemical studies as a model compound for glycosylation processes and in the formulation of nutraceuticals due to its potential antioxidant properties. Its complex structure makes it valuable for studying carbohydrate-based interactions in biological systems.

Is 3,5-Dihydroxy-4-[3-(4-hydroxyphenyl)propanoyl]phenyl 2-O-(6-deoxy-alpha-L-mannopyranosyl)-beta-L-glucopyranoside (CAS: 18916-17-1) safe?

The safety of 3,5-Dihydroxy-4-[3-(4-hydroxyphenyl)propanoyl]phenyl 2-O-(6-deoxy-alpha-L-mannopyranosyl)-beta-L-glucopyranoside (CAS: 18916-17-1) depends on its application and exposure level. It is generally considered safe in controlled research settings. However, proper handling is required to avoid skin or eye contact, and protective equipment such as gloves and goggles should be used. Safety data sheets (SDS) should be consulted for detailed handling and emergency procedures.

How should 3,5-Dihydroxy-4-[3-(4-hydroxyphenyl)propanoyl]phenyl 2-O-(6-deoxy-alpha-L-mannopyranosyl)-beta-L-glucopyranoside (CAS: 18916-17-1) be stored?

This compound should be stored in a cool, dry, and dark place to maintain its stability. It is recommended to keep it in a sealed container at a temperature below 25°C and away from moisture. Avoid exposure to direct sunlight and ensure it is stored in a well-ventilated area. Proper labeling and storage conditions are essential to prevent degradation and ensure safe handling.