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METHYL-2,3,4-TRI-O-BENZYL-6-(S)-(2',3',4',6'-TETRA-O-ACETYL-BETA-D-GLUCOPYRANOSYL-6-THIO-ALPHA-D-GLUCOPYRANOSIDE
SpectraBase Compound ID 9gc3OxufT51
InChI InChI=1S/C42H50O14S/c1-26(43)48-24-33-36(52-27(2)44)38(53-28(3)45)40(54-29(4)46)42(56-33)57-25-34-35(49-21-30-15-9-6-10-16-30)37(50-22-31-17-11-7-12-18-31)39(41(47-5)55-34)51-23-32-19-13-8-14-20-32/h6-20,33-42H,21-25H2,1-5H3/t33-,34+,35+,36-,37-,38+,39+,40-,41-,42+/m1/s1
InChIKey YCOZCRVNJATBID-VBBRGZCZSA-N
Mol Weight 810.9 g/mol
Molecular Formula C42H50O14S
Exact Mass 810.292127 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID J0FfvJZtPKt
Name METHYL-2,3,4-TRI-O-BENZYL-6-(S)-(2',3',4',6'-TETRA-O-ACETYL-BETA-D-GLUCOPYRANOSYL-6-THIO-ALPHA-D-GLUCOPYRANOSIDE
Compound Number 15
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C42H50O14S
InChI InChI=1S/C42H50O14S/c1-26(43)48-24-33-36(52-27(2)44)38(53-28(3)45)40(54-29(4)46)42(56-33)57-25-34-35(49-21-30-15-9-6-10-16-30)37(50-22-31-17-11-7-12-18-31)39(41(47-5)55-34)51-23-32-19-13-8-14-20-32/h6-20,33-42H,21-25H2,1-5H3/t33-,34+,35+,36-,37-,38+,39+,40-,41-,42+/m1/s1
InChIKey YCOZCRVNJATBID-VBBRGZCZSA-N
Literature Reference Author S.S.WENG,Y.D.LIN,C.T.CHEN
Literature Reference Citation ORG.LETTERS,8,5633(2006)
Literature Reference DOI 10.1021/ol062375g
Molecular Weight 810.911 g/mol
Sample ID 59712
Solvent CDCl3