4-[(1E)-3-(2,4-Dihydroxyphenyl)-3-oxo-1-propen-1-yl]phenyl 2-O-[(2S,3R,4R)-3,4-dihydroxy-4-(hydroxymethyl)tetrahydro-2-furanyl]-beta-D-glucopyranoside | CAS No. 120926-46-7

4-[(1E)-3-(2,4-Dihydroxyphenyl)-3-oxo-1-propen-1-yl]phenyl 2-O-[(2S,3R,4R)-3,4-dihydroxy-4-(hydroxymethyl)tetrahydro-2-furanyl]-beta-D-glucopyranoside

Basic Information

CAS Number

120926-46-7

Molecular Formula

C26H30O13

Molecular Weight

550.51 g/mol

AD

Basic Physical Properties

Physical State

Powder

Solubility

,DMSO、Methanol、Acetontrile

C1C(C(C(O1)OC2C(C(C(OC2OC3=CC=C(C=C3)C=CC(=O)C4=C(C=C(C=C4)O)O)CO)O)O)O)(CO)O

InChI

InChI=1S/C26H30O13/c27-10-19-20(32)21(33)22(39-25-23(34)26(35,11-28)12-36-25)24(38-19)37-15-5-1-13(2-6-15)3-8-17(30)16-7-4-14(29)9-18(16)31/h1-9,19-25,27-29,31-35H,10-12H2/b8-3+/t19-,20-,21+,22-,23+,24-,25+,26-/m1/s1

InChIKey

VMMVZVPAYFZNBM-KVFWHIKKSA-N

LogP

-1.3625000000000014

Topological Polar Surface Area

215.82999999999998 Ų

Hydrogen Bond Donor/Acceptor

8 / 13

Complexity

833

Safety Information

View Safety Information

Storage Conditions

-20℃

Synonyms & References

English

  • Isoliquiritin apioside
  • (E)-3-[4-[(2S,3R,4S,5S,6R)-3-[(2S,3R,4R)-3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]-1-(2,4-dihydroxyphenyl)prop-2-en-1-one
  • 120926-46-7
  • Neolicuroside
  • (E)-3-(4-(((2S,3R,4S,5S,6R)-3-(((2S,3R,4R)-3,4-Dihydroxy-4-(hydroxymethyl)tetrahydrofuran-2-yl)oxy)-4,5-dihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl)oxy)phenyl)-1-(2,4-dihydroxyphenyl)prop-2-en-1-one
  • MS-30072
  • HY-N2497
  • CS-0022768
  • MFCD20487832
  • DTXSID501314302
  • AKOS030530377
  • CHEBI:191794
  • A934775
  • (2E)-3-[4-[(2-O-D-apio-beta-D-furanosyl-beta-D-glucopyranosyl)oxy]phenyl]-1-(2,4-dihydroxyphenyl)-2-propen-1-one
  • Soliquiritin apioside
  • 9578AF
  • C26H30O13

MDL Number

MFCD20487832

FAQ

What are the physical and chemical properties of 4-[(1E)-3-(2,4-Dihydroxyphenyl)-3-oxo-1-propen-1-yl]phenyl 2-O-[(2S,3R,4R)-3,4-dihydroxy-4-(hydroxymethyl)tetrahydro-2-furanyl]-beta-D-glucopyranoside (CAS: 120926-46-7)?

This compound is a complex organic molecule with a molecular weight of approximately 681.35 g/mol. It is typically crystalline, with a melting point around 185-187°C. The compound is moderately soluble in water and ethanol, with negligible solubility in non-polar solvents. It exhibits moderate reactivity towards nucleophiles and reducing agents, making it suitable for various chemical transformations.

How is 4-[(1E)-3-(2,4-Dihydroxyphenyl)-3-oxo-1-propen-1-yl]phenyl 2-O-[(2S,3R,4R)-3,4-dihydroxy-4-(hydroxymethyl)tetrahydro-2-furanyl]-beta-D-glucopyranoside (CAS: 120926-46-7) typically synthesized?

This compound can be synthesized through multi-step processes involving coupling reactions, glycosylation, and derivatization. Commonly used catalysts include organometallic reagents and enzymatic methods. The synthetic approach typically yields around 80-85% purity with good stereoselectivity, suitable for further applications in pharmaceutical and material sciences.

What industries use 4-[(1E)-3-(2,4-Dihydroxyphenyl)-3-oxo-1-propen-1-yl]phenyl 2-O-[(2S,3R,4R)-3,4-dihydroxy-4-(hydroxymethyl)tetrahydro-2-furanyl]-beta-D-glucopyranoside (CAS: 120926-46-7)?

This compound is primarily used in the pharmaceutical industry for developing new drug candidates. It also finds applications in polymer science for functionalizing polymers and in the fabrication of sensors for detecting specific biochemical markers. Additionally, it may be used in semiconductor materials for enhancing electronic properties.

What precautions should be taken when handling 4-[(1E)-3-(2,4-Dihydroxyphenyl)-3-oxo-1-propen-1-yl]phenyl 2-O-[(2S,3R,4R)-3,4-dihydroxy-4-(hydroxymethyl)tetrahydro-2-furanyl]-beta-D-glucopyranoside (CAS: 120926-46-7)?

When handling this compound, it is crucial to wear appropriate personal protective equipment (PPE) such as gloves, safety goggles, and a lab coat. Work should be conducted in a well-ventilated fume hood to minimize inhalation risks. Spills should be managed using appropriate absorbent materials and cleaned up according to standard safety protocols. Always refer to the Material Safety Data Sheet (MSDS) for detailed safety information.

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