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2-ACETAMIDO-1,6-DI-O-ACETYL-3-O-BENZOYL-2-DEOXY-4-THIO-4-S-[3,4,6-TRI-O-BENZOYL-2-DEOXY-2-(2,2,2-TRICHLOROETHOXYCARBONYLAMINO)-BETA-D-GLUCOPYRANOS

Compound with spectra: 1 NMR

2-ACETAMIDO-1,6-DI-O-ACETYL-3-O-BENZOYL-2-DEOXY-4-THIO-4-S-[3,4,6-TRI-O-BENZOYL-2-DEOXY-2-(2,2,2-TRICHLOROETHOXYCARBONYLAMINO)-BETA-D-GLUCOPYRANOS
SpectraBase Compound ID 9QDy17iqGQB
InChI InChI=1S/C49H47Cl3N2O17S/c1-27(55)53-36-40(71-45(61)33-22-14-7-15-23-33)41(35(25-63-28(2)56)67-46(36)66-29(3)57)72-47-37(54-48(62)65-26-49(50,51)52)39(70-44(60)32-20-12-6-13-21-32)38(69-43(59)31-18-10-5-11-19-31)34(68-47)24-64-42(58)30-16-8-4-9-17-30/h4-23,34-41,46-47H,24-26H2,1-3H3,(H,53,55)(H,54,62)/t34-,35-,36-,37-,38-,39-,40-,41-,46+,47+/m1/s1
InChIKey VXSGZHLALPRJJE-BEHJZZETSA-N
Mol Weight 1074.3 g/mol
Molecular Formula C49H47Cl3N2O17S
Exact Mass 1072.166102 g/mol
Enantiomer InChIKey VXSGZHLALPRJJE-QSZKCYCNSA-N

View Spectrum of 2-ACETAMIDO-1,6-DI-O-ACETYL-3-O-BENZOYL-2-DEOXY-4-THIO-4-S-[3,4,6-TRI-O-BENZOYL-2-DEOXY-2-(2,2,2-TRICHLOROETHOXYCARBONYLAMINO)-BETA-D-GLUCOPYRANOS

13C NMR Spectrum
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CDCl3
Title Journal or Book Year
Synthesis of S-linked thiooligosaccharide analogues of Nod factors. Part 1: selectively N-protected 4-thiochitobiose precursors Journal of the Chemical Society, Perkin Transactions 1 1998
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