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2-[2-DEOXY-5-O-(4,4'-DIMETHOXYTRITYL)-3-O-SUCCINYL-BETA-D-ERYTHRO-PENTOFURANOSYL]-5-{[(DIMETHYLAMINO)-METHYLIDENE]-AMINO}-2,6-DIHYDRO-7H-1,2,3-TRIAZOLO-[4,5-D]
SpectraBase Compound ID LXLrqXi0oDc
InChI InChI=1S/C37H39N7O9/c1-43(2)22-38-36-39-34-33(35(48)40-36)41-44(42-34)30-20-28(53-32(47)19-18-31(45)46)29(52-30)21-51-37(23-8-6-5-7-9-23,24-10-14-26(49-3)15-11-24)25-12-16-27(50-4)17-13-25/h5-17,22,28-30H,18-21H2,1-4H3,(H,45,46)(H,39,40,42,48)/b38-22+/t28-,29+,30+/m0/s1
InChIKey NTVOLWAFLYHOEW-LRAIOHJVSA-N
Mol Weight 725.8 g/mol
Molecular Formula C37H39N7O9
Exact Mass 725.280926 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2cKB6Yrjkqp
Name 2-[2-DEOXY-5-O-(4,4'-DIMETHOXYTRITYL)-3-O-SUCCINYL-BETA-D-ERYTHRO-PENTOFURANOSYL]-5-{[(DIMETHYLAMINO)-METHYLIDENE]-AMINO}-2,6-DIHYDRO-7H-1,2,3-TRIAZOLO-[4,5-D]
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C37H39N7O9
InChI InChI=1S/C37H39N7O9/c1-43(2)22-38-36-39-34-33(35(48)40-36)41-44(42-34)30-20-28(53-32(47)19-18-31(45)46)29(52-30)21-51-37(23-8-6-5-7-9-23,24-10-14-26(49-3)15-11-24)25-12-16-27(50-4)17-13-25/h5-17,22,28-30H,18-21H2,1-4H3,(H,45,46)(H,39,40,42,48)/b38-22+/t28-,29+,30+/m0/s1
InChIKey NTVOLWAFLYHOEW-LRAIOHJVSA-N
Literature Reference Author F.SEELA,S.LAMPE
Literature Reference Citation HELV.CHIM.ACTA,77,1003(1994)
Literature Reference DOI 10.1002/hlca.19940770413
Molecular Weight 725.758 g/mol
Solvent DMSO-D6
Source File Reference UWPR1237