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2,5-BIS-(2',3',4',6'-TETRA-O-ACETYL-BETA-D-GLUCOPYRANOSYLTHIO)-BENZENE-1,4-DIOL
SpectraBase Compound ID HnFYVxt6LT3
InChI InChI=1S/C34H42O20S2/c1-13(35)45-11-23-27(47-15(3)37)29(49-17(5)39)31(51-19(7)41)33(53-23)55-25-9-22(44)26(10-21(25)43)56-34-32(52-20(8)42)30(50-18(6)40)28(48-16(4)38)24(54-34)12-46-14(2)36/h9-10,23-24,27-34,43-44H,11-12H2,1-8H3/t23-,24+,27-,28+,29+,30-,31-,32+,33+,34-
InChIKey PDRCUUIXCFRZNA-FBABDHFGSA-N
Mol Weight 834.8 g/mol
Molecular Formula C34H42O20S2
Exact Mass 834.171086 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HdJy3Ls083P
Name 2,5-BIS-(2',3',4',6'-TETRA-O-ACETYL-BETA-D-GLUCOPYRANOSYLTHIO)-BENZENE-1,4-DIOL
Compound Number 33
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C34H42O20S2
InChI InChI=1S/C34H42O20S2/c1-13(35)45-11-23-27(47-15(3)37)29(49-17(5)39)31(51-19(7)41)33(53-23)55-25-9-22(44)26(10-21(25)43)56-34-32(52-20(8)42)30(50-18(6)40)28(48-16(4)38)24(54-34)12-46-14(2)36/h9-10,23-24,27-34,43-44H,11-12H2,1-8H3/t23-,24+,27-,28+,29+,30-,31-,32+,33+,34-
InChIKey PDRCUUIXCFRZNA-FBABDHFGSA-N
Literature Reference Author M.SCHNABELRAUCH,A.VASELLA,S.G.WITHERS
Literature Reference Citation HELV.CHIM.ACTA,77,778(1994)
Literature Reference DOI 10.1002/hlca.19940770319
Molecular Weight 834.815 g/mol
Solvent CDCl3
Source File Reference UWSK2902