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METHYL-2,3-DI-O-ACETYL-6-O-PARA-TOLUENESULFONYL-BETA-D-GALACTOPYRANOSYL-(1,4)-2,3,6-TRI-O-ACETYL-BETA-D-GLUCOPYRANOSIDE
SpectraBase Compound ID 9UNoeH0L41a
InChI InChI=1S/C30H40O18S/c1-14-8-10-20(11-9-14)49(37,38)41-13-21-23(36)25(42-16(3)32)27(44-18(5)34)30(46-21)48-24-22(12-40-15(2)31)47-29(39-7)28(45-19(6)35)26(24)43-17(4)33/h8-11,21-30,36H,12-13H2,1-7H3/t21-,22-,23+,24-,25+,26+,27-,28-,29-,30+/m1/s1
InChIKey UAYQMSFXJNYEEA-KJRJSTJOSA-N
Mol Weight 720.7 g/mol
Molecular Formula C30H40O18S
Exact Mass 720.193536 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 58XP7W8r4I
Name METHYL-2,3-DI-O-ACETYL-6-O-PARA-TOLUENESULFONYL-BETA-D-GALACTOPYRANOSYL-(1,4)-2,3,6-TRI-O-ACETYL-BETA-D-GLUCOPYRANOSIDE
Compound Number 17
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C30H40O18S
InChI InChI=1S/C30H40O18S/c1-14-8-10-20(11-9-14)49(37,38)41-13-21-23(36)25(42-16(3)32)27(44-18(5)34)30(46-21)48-24-22(12-40-15(2)31)47-29(39-7)28(45-19(6)35)26(24)43-17(4)33/h8-11,21-30,36H,12-13H2,1-7H3/t21-,22-,23+,24-,25+,26+,27-,28-,29-,30+/m1/s1
InChIKey UAYQMSFXJNYEEA-KJRJSTJOSA-N
Literature Reference Author A.FAZLI,S.J.BRADLEY,M.J.KIEFEL,C.JOLLY,I.H.HOLMES,M.V.ITZSTE IN
Literature Reference Citation J.MED.CHEM.,44,3292(2001)
Literature Reference DOI 10.1021/jm0100887
Molecular Weight 720.697 g/mol
Sample ID 45086
Solvent CDCl3