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CAS 915095-99-7

:

(1S)-1,5-Anhydro-1-C-[4-chloro-3-[[4-[[(3S)-tetrahydro-3-furanyl]oxy]phenyl]methyl]phenyl]-D-glucitol tetraacetate

Description:
The chemical substance known as (1S)-1,5-Anhydro-1-C-[4-chloro-3-[[4-[[(3S)-tetrahydro-3-furanyl]oxy]phenyl]methyl]phenyl]-D-glucitol tetraacetate, with the CAS number 915095-99-7, is a complex organic compound characterized by its intricate molecular structure. It features a glucitol backbone, which is a sugar alcohol derived from glucose, modified with multiple functional groups, including acetates and a chloro-substituted phenyl moiety. The presence of the tetrahydro-furanyl group indicates a cyclic ether structure, contributing to the compound's potential biological activity. This compound may exhibit properties relevant to medicinal chemistry, particularly in the context of drug design or as a potential therapeutic agent. Its specific stereochemistry, denoted by the (1S) and (3S) configurations, suggests that it may interact with biological systems in a stereospecific manner, influencing its efficacy and safety profile. Overall, this substance represents a significant example of synthetic organic chemistry with potential applications in pharmaceuticals or biochemistry.
Formula:C31H35ClO11
InChI:InChI=1S/C31H35ClO11/c1-17(33)38-16-27-29(39-18(2)34)31(41-20(4)36)30(40-19(3)35)28(43-27)22-7-10-26(32)23(14-22)13-21-5-8-24(9-6-21)42-25-11-12-37-15-25/h5-10,14,25,27-31H,11-13,15-16H2,1-4H3/t25-,27+,28-,29+,30-,31-/m0/s1
InChI key:IVTYEGRDCQLUJE-KTUPMIEBSA-N
SMILES:CC(=O)OC[C@@H]1[C@H]([C@@H]([C@H]([C@@H](O1)C2=CC(=C(C=C2)Cl)CC3=CC=C(C=C3)O[C@H]4CCOC4)OC(=O)C)OC(=O)C)OC(=O)C
Synonyms:
  • (1S)-1,5-anhydro-2,3,4,6-tetra-O-acteyl-1-C-[4-chloro-3-[[4-[[(3S)-tetrahydrofu-ran-3-yl]oxy]phenyl] methyl]phenyl]-D-Glucitol
  • Acetoxy Empagliflozin
  • (1S)-1,5-Anhydro-1-C-[4-chloro-3-[[4-[[(3S)-tetrahydro-3-furanyl]oxy]phenyl]methyl]phenyl]-D-glucitol tetraacetate
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