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2,3,4-TRI-O-ACETYL-1,6-ANHYDRO-6-DEOXY-6-TRIPHENYLPHOSPHONIOAMINO-BETA-D-GLUCOPYRANOSE-P-TOLYLSULFONATE

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2,3,4-TRI-O-ACETYL-1,6-ANHYDRO-6-DEOXY-6-TRIPHENYLPHOSPHONIOAMINO-BETA-D-GLUCOPYRANOSE-P-TOLYLSULFONATE
SpectraBase Compound ID KN9AYkPbCKb
InChI InChI=1S/C30H31NO7P.C7H8O3S/c1-20(32)35-27-26-19-31(30(38-26)29(37-22(3)34)28(27)36-21(2)33)39(23-13-7-4-8-14-23,24-15-9-5-10-16-24)25-17-11-6-12-18-25;1-6-2-4-7(5-3-6)11(8,9)10/h4-18,26-30H,19H2,1-3H3;2-5H,1H3,(H,8,9,10)/q+1;/p-1/t26-,27-,28-,29-,30-;/m1./s1
InChIKey QHVBLOAAEHWEBW-OUPONQGGSA-M
Mol Weight 719.74 g/mol
Molecular Formula C37H38NO10PS
Exact Mass 719.195405 g/mol

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

31P Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BnteeT0Xmip
Name 2,3,4-TRI-O-ACETYL-1,6-ANHYDRO-6-DEOXY-6-TRIPHENYLPHOSPHONIOAMINO-BETA-D-GLUCOPYRANOSE-P-TOLYLSULFONATE
Compound Number 7
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C37H38NO10PS
InChI InChI=1S/C30H31NO7P.C7H8O3S/c1-20(32)35-27-26-19-31(30(38-26)29(37-22(3)34)28(27)36-21(2)33)39(23-13-7-4-8-14-23,24-15-9-5-10-16-24)25-17-11-6-12-18-25;1-6-2-4-7(5-3-6)11(8,9)10/h4-18,26-30H,19H2,1-3H3;2-5H,1H3,(H,8,9,10)/q+1;/p-1/t26-,27-,28-,29-,30-;/m1./s1
InChIKey QHVBLOAAEHWEBW-OUPONQGGSA-M
Literature Reference Author D.LAFONT,A.WOLLNY,P.BOULLANGER
Literature Reference Citation CARBOHYDR.RES.,310,9(1998)
Literature Reference DOI 10.1016/S0008-6215(98)00089-5
Solvent CDCl3
Source File Reference UWRU5188