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1-(N,N-DIBENZYLAMINO)-3-ACETAMIDO-1,3-DIDEOXY-ALPHA-D-GLUCO-HEPT-2-ULO-PYRANOSIDE/FURANOSIDE;MIXTURE
SpectraBase Compound ID FlYfbpQ8WC5
InChI InChI=1S/2C23H30N2O6/c1-16(27)24-22-20(29)21(19(28)14-26)31-23(22,30)15-25(12-17-8-4-2-5-9-17)13-18-10-6-3-7-11-18;1-16(27)24-22-21(29)20(28)19(14-26)31-23(22,30)15-25(12-17-8-4-2-5-9-17)13-18-10-6-3-7-11-18/h2*2-11,19-22,26,28-30H,12-15H2,1H3,(H,24,27)/t19-,20+,21-,22-,23+;19-,20-,21+,22-,23+/m11/s1
InChIKey NPVMSGMNCOXDEU-XTWQWHOESA-N
Mol Weight 861.0 g/mol
Molecular Formula C46H60N4O12
Exact Mass 860.420773 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 46ngTGXKUOW
Name 1-(N,N-DIBENZYLAMINO)-3-ACETAMIDO-1,3-DIDEOXY-ALPHA-D-GLUCO-HEPT-2-ULO-PYRANOSIDE/FURANOSIDE;MIXTURE
Compound Number 33A +33B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C46H60N4O12
InChI InChI=1S/2C23H30N2O6/c1-16(27)24-22-20(29)21(19(28)14-26)31-23(22,30)15-25(12-17-8-4-2-5-9-17)13-18-10-6-3-7-11-18;1-16(27)24-22-21(29)20(28)19(14-26)31-23(22,30)15-25(12-17-8-4-2-5-9-17)13-18-10-6-3-7-11-18/h2*2-11,19-22,26,28-30H,12-15H2,1H3,(H,24,27)/t19-,20+,21-,22-,23+;19-,20-,21+,22-,23+/m11/s1
InChIKey NPVMSGMNCOXDEU-XTWQWHOESA-N
Literature Reference Author K.GALLAS,G.POTOTSCHNIG,F.ADANITSCH,A.E.STUETZ,T.M.WRODNIGG
Literature Reference Citation BEIL.J.ORG.CHEM.,8,1619(2012)
Literature Reference DOI 10.3762/bjoc.8.185
Molecular Weight 861.002 g/mol
Solvent CD3OD
Source File Reference UWIR11097