2-(3-Hydroxy-4-methoxyphenyl)ethyl 6-deoxy-alpha-L-mannopyranosyl-(1->3)-[beta-D-galactopyranosyl-(1->6)]-4-O-[(2E)-3-(4-hydroxy-3-methoxyphenyl)-2-propenoyl]-beta-D-glucopyranoside

Basic Information

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CAS Number

120406-37-3

Molecular Formula

C37H50O20

Molecular Weight

814.79 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Esters

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

Boiling Point

1020.3°Cat760mmHg

Flash Point

309.9°C

Refractive Index

1.656

SMILES

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CC1C(C(C(C(O1)OC2C(C(OC(C2OC(=O)C=CC3=CC(=C(C=C3)O)OC)COC4C(C(C(C(O4)CO)O)O)O)OCCC5=CC(=C(C=C5)OC)O)O)O)O)O

InChI

InChI=1S/C37H50O20/c1-16-26(42)28(44)31(47)37(53-16)57-34-32(48)36(51-11-10-18-5-8-21(49-2)20(40)12-18)55-24(15-52-35-30(46)29(45)27(43)23(14-38)54-35)33(34)56-25(41)9-6-17-4-7-19(39)22(13-17)50-3/h4-9,12-13,16,23-24,26-40,42-48H,10-11,14-15H2,1-3H3/b9-6+/t16-,23+,24+,26-,27-,28+,29-,30+,31+,32+,33+,34+,35+,36+,37-/m0/s1

InChIKey

FXFHFOSEURHWMO-AQHLZYGVSA-N

LogP

-2.585699999999993

Topological Polar Surface Area

302.44 Å²

Hydrogen Bond Donor/Acceptor

10 / 20

Complexity

1260

Safety Information

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Storage Conditions

2-8℃

Synonyms & References

English

CS-0019537
MS-31509
AC1NQZ2N
HY-N2218
Q27107053
C10473
JionosideB1
DTXSID20415192
[(2R,3R,4R,5R,6R)-5-hydroxy-6-[2-(3-hydroxy-4-methoxyphenyl)ethoxy]-2-[[(2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]-4-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-3-yl] (E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate
Jionoside B1
[(2R,3R,4R,5R,6R)-5-hydroxy-6-[2-(3-hydroxy-4-methoxy-phenyl)ethoxy]-2-[[(2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxymethyl]-4-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyl-tetrahydropyran-2-yl]oxy-tetrahydropyran-3-yl] (E)-3-(4-hydroxy-3-methoxy-phenyl)prop-2-enoate
CHEBI:6090
120406-37-3
(2R,3R,4R,5R,6R)-5-hydroxy-6-[2-(3-hydroxy-4-methoxyphenyl)ethoxy]-2-({[(2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}methyl)-4-{[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}oxan-3-yl (2E)-3-(4-hydroxy-3-methoxyphenyl)prop-2
[(2R,3R,4R,5R,6R)-5-hydroxy-6-[2-(3-hydroxy-4-methoxyphenyl)ethoxy]-2-[[(2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]-4-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]o
b-D-Glucopyranoside,2-(3-hydroxy-4-methoxyphenyl)ethyl O-6-deoxy-a-L-mannopyranosyl-(1&reg
6)]-, 4-[(2E)-3-(4-hydroxy-3-methoxyphenyl)-2-propenoate]
6''-O-beta-D-Glucopyranosylmartynoside
[(2R,3R,4R,5R,6R)-5-Hydroxy-6-[2-(3-hydroxy-4-methoxyphenyl)ethoxy]-2-[[(2R,3R,4S,5S,6R)-3,4,5-trihy
A17087
β-D-Glucopyranoside, 2-(3-hydroxy-4-methoxyphenyl)ethyl O-6-deoxy-α-L-mannopyranosyl-(1→3)-O-[β-D-ga...

MDL Number

MFCD31630703

FAQ

What regulatory guidelines apply to 2-(3-Hydroxy-4-methoxyphenyl)ethyl 6-deoxy-alpha-L-mannopyranosyl-(1->3)-[beta-D-galactopyranosyl-(1->6)]-4-O-[(2E)-3-(4-hydroxy-3-methoxyphenyl)-2-propenoyl]-beta-D-glucopyranoside (CAS: 120406-37-3)?

This compound requires adherence to both REACH regulations for European Union manufacturers and importers, which mandates registration, evaluation, and authorization of chemicals. Additionally, it must comply with GHS (Globally Harmonized System of Classification and Labelling of Chemicals) for hazardous substance classification. In the United States, it should follow FDA guidelines for food contact substances and EPA regulations for environmental protection.

Are there alternatives to 2-(3-Hydroxy-4-methoxyphenyl)ethyl 6-deoxy-alpha-L-mannopyranosyl-(1->3)-[beta-D-galactopyranosyl-(1->6)]-4-O-[(2E)-3-(4-hydroxy-3-methoxyphenyl)-2-propenoyl]-beta-D-glucopyranoside (CAS: 120406-37-3) in synthesis?

In synthesis, commonly used alternatives include isomers with similar functional groups, such as 2-(3-hydroxyphenyl)ethyl derivatives. Alternative reagents like 4-hydroxy-3-methoxybenzaldehyde or other carboxylic acids can also be considered as substitutes depending on the specific reaction conditions and desired product properties.

What is the market or research trend for 2-(3-Hydroxy-4-methoxyphenyl)ethyl 6-deoxy-alpha-L-mannopyranosyl-(1->3)-[beta-D-galactopyranosyl-(1->6)]-4-O-[(2E)-3-(4-hydroxy-3-methoxyphenyl)-2-propenoyl]-beta-D-glucopyranoside (CAS: 120406-37-3)?

The research trend for this compound is increasing, particularly in the development of novel antiviral and anti-inflammatory agents. Market demand is growing due to its potential biological activities, with a focus on exploring its efficacy in medicinal chemistry and pharmaceutical applications. However, further studies are needed to establish its safety and effectiveness.

How should waste containing 2-(3-Hydroxy-4-methoxyphenyl)ethyl 6-deoxy-alpha-L-mannopyranosyl-(1->3)-[beta-D-galactopyranosyl-(1->6)]-4-O-[(2E)-3-(4-hydroxy-3-methoxyphenyl)-2-propenoyl]-beta-D-glucopyranoside (CAS: 120406-37-3) be handled?

Waste containing this compound should be collected in appropriate containers and incinerated under controlled conditions if it is considered hazardous. For non-hazardous waste, it can be disposed of in accordance with local regulations. Environmental precautions include proper labeling and handling to prevent contamination of soil and water. Professional waste disposal services are recommended to ensure compliance with environmental protection standards.