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METHYL-2,3,4,6-TETRA-O-BENZOYL-4-S-(2',3',4',6'-TETRA-O-ACETYL-BETA-D-GALACTOPYRANOSYL-1'-THIO)-4-THIO-ALPHA-D-GLUCOPYRANOSIDE

View entire compound with spectra: 1 NMR

METHYL-2,3,4,6-TETRA-O-BENZOYL-4-S-(2',3',4',6'-TETRA-O-ACETYL-BETA-D-GALACTOPYRANOSYL-1'-THIO)-4-THIO-ALPHA-D-GLUCOPYRANOSIDE
SpectraBase Compound ID 6ubat2V65XB
InChI InChI=1S/C42H44O17S2/c1-23(43)51-21-30-32(53-24(2)44)33(54-25(3)45)36(55-26(4)46)42(57-30)61-60-37-31(22-52-38(47)27-15-9-6-10-16-27)56-41(50-5)35(59-40(49)29-19-13-8-14-20-29)34(37)58-39(48)28-17-11-7-12-18-28/h6-20,30-37,41-42H,21-22H2,1-5H3/t30-,31+,32+,33+,34+,35+,36-,37+,41-,42+/m1/s1
InChIKey YICWMZVOOHSOEO-OBRFHXBCSA-N
Mol Weight 884.9 g/mol
Molecular Formula C42H44O17S2
Exact Mass 884.201992 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Je7srnIMEzb
Name METHYL-2,3,4,6-TETRA-O-BENZOYL-4-S-(2',3',4',6'-TETRA-O-ACETYL-BETA-D-GALACTOPYRANOSYL-1'-THIO)-4-THIO-ALPHA-D-GLUCOPYRANOSIDE
Compound Number 7
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C42H44O17S2
InChI InChI=1S/C42H44O17S2/c1-23(43)51-21-30-32(53-24(2)44)33(54-25(3)45)36(55-26(4)46)42(57-30)61-60-37-31(22-52-38(47)27-15-9-6-10-16-27)56-41(50-5)35(59-40(49)29-19-13-8-14-20-29)34(37)58-39(48)28-17-11-7-12-18-28/h6-20,30-37,41-42H,21-22H2,1-5H3/t30-,31+,32+,33+,34+,35+,36-,37+,41-,42+/m1/s1
InChIKey YICWMZVOOHSOEO-OBRFHXBCSA-N
Literature Reference Author N.CHAKKA,B.D.JOHNSTON,B.M.PINTO
Literature Reference Citation CAN.J.CHEM.,83,929(2005)
Literature Reference DOI 10.1139/v05-107
Molecular Weight 884.921 g/mol
Solvent CDCl3
Source File Reference UWLU30205