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(2-ACETAMIDO-3,4,6-TRI-O-BENZYL-2-DEOXY-D-GLUCOPYRANOSYLIDENE)-AMINO-4-METHYLBENZENE-1-SULFONATE
SpectraBase Compound ID 83hnwUADWzj
InChI InChI=1S/C36H38N2O8S/c1-26-18-20-31(21-19-26)47(40,41)46-38-36-33(37-27(2)39)35(44-24-30-16-10-5-11-17-30)34(43-23-29-14-8-4-9-15-29)32(45-36)25-42-22-28-12-6-3-7-13-28/h3-21,32-35H,22-25H2,1-2H3,(H,37,39)/b38-36-/t32-,33-,34-,35-/m1/s1
InChIKey KVOBXWFTYMYUER-VMXMXECKSA-N
Mol Weight 658.8 g/mol
Molecular Formula C36H38N2O8S
Exact Mass 658.234887 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AcbD68bJhRI
Name (2-ACETAMIDO-3,4,6-TRI-O-BENZYL-2-DEOXY-D-GLUCOPYRANOSYLIDENE)-AMINO-4-METHYLBENZENE-1-SULFONATE
Compound Number 46
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C36H38N2O8S
InChI InChI=1S/C36H38N2O8S/c1-26-18-20-31(21-19-26)47(40,41)46-38-36-33(37-27(2)39)35(44-24-30-16-10-5-11-17-30)34(43-23-29-14-8-4-9-15-29)32(45-36)25-42-22-28-12-6-3-7-13-28/h3-21,32-35H,22-25H2,1-2H3,(H,37,39)/b38-36-/t32-,33-,34-,35-/m1/s1
InChIKey KVOBXWFTYMYUER-VMXMXECKSA-N
Literature Reference Author A.VASELLA,C.WITZIG,C.WALDRAFF,P.UHLMANN,K.BRINER,B.BERNET,L. PANZA,R.HUSI
Literature Reference Citation HELV.CHIM.ACTA,76,2847(1993)
Literature Reference DOI 10.1002/hlca.19930760811
Molecular Weight 658.766 g/mol
Solvent CDCl3
Source File Reference UWCS16305