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METHYL-(PARA-TOLYL-4-O-ACETYL-2,3-DI-O-BENZYL-1-THIO-BETA-D-GALACTOPYRANOSIDE)-URONATE
SpectraBase Compound ID AiU3KdewZ3m
InChI InChI=1S/C30H32O7S/c1-20-14-16-24(17-15-20)38-30-28(35-19-23-12-8-5-9-13-23)25(34-18-22-10-6-4-7-11-22)26(36-21(2)31)27(37-30)29(32)33-3/h4-17,25-28,30H,18-19H2,1-3H3/t25-,26+,27-,28+,30-/m1/s1
InChIKey ICJWMWGCSVJVIY-JQWBDLNTSA-N
Mol Weight 536.6 g/mol
Molecular Formula C30H32O7S
Exact Mass 536.186875 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 59K8z3nJrGV
Name METHYL-(PARA-TOLYL-4-O-ACETYL-2,3-DI-O-BENZYL-1-THIO-BETA-D-GALACTOPYRANOSIDE)-URONATE
Compound Number 5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C30H32O7S
InChI InChI=1S/C30H32O7S/c1-20-14-16-24(17-15-20)38-30-28(35-19-23-12-8-5-9-13-23)25(34-18-22-10-6-4-7-11-22)26(36-21(2)31)27(37-30)29(32)33-3/h4-17,25-28,30H,18-19H2,1-3H3/t25-,26+,27-,28+,30-/m1/s1
InChIKey ICJWMWGCSVJVIY-JQWBDLNTSA-N
Literature Reference Author A.E.CHRISTINA,J.A.MUNS,J.Q.A.OLIVIER,L.VISSER,B.HAGEN,L.J.V. D.BOS,H.S.OVERKLEEFT
Literature Reference Citation EUR.J.ORG.CHEM.,2012,5729(2012)
Literature Reference DOI 10.1002/ejoc.201200717
Molecular Weight 536.640 g/mol
Solvent CDCl3
Source File Reference UWLU83862