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4-O-(2-ACETAMIDO-3,4,6-TRI-O-BENZYL-2-DEOXY-BETA-D-GALACTOPYRANOSYL)-N-BENZYL-1,5-DIDEOXY-1,5-IMINO-D-GLUCITOL

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4-O-(2-ACETAMIDO-3,4,6-TRI-O-BENZYL-2-DEOXY-BETA-D-GALACTOPYRANOSYL)-N-BENZYL-1,5-DIDEOXY-1,5-IMINO-D-GLUCITOL
SpectraBase Compound ID EGMFxDSjmSE
InChI InChI=1S/C42H50N2O9/c1-29(46)43-37-41(51-27-33-20-12-5-13-21-33)40(50-26-32-18-10-4-11-19-32)36(28-49-25-31-16-8-3-9-17-31)52-42(37)53-39-34(24-45)44(23-35(47)38(39)48)22-30-14-6-2-7-15-30/h2-21,34-42,45,47-48H,22-28H2,1H3,(H,43,46)/t34-,35+,36-,37-,38-,39-,40+,41-,42+/m1/s1
InChIKey HGTYYTKVOGOFQD-MGJWTMGOSA-N
Mol Weight 726.9 g/mol
Molecular Formula C42H50N2O9
Exact Mass 726.351631 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8W2pM63PNn5
Name 4-O-(2-ACETAMIDO-3,4,6-TRI-O-BENZYL-2-DEOXY-BETA-D-GALACTOPYRANOSYL)-N-BENZYL-1,5-DIDEOXY-1,5-IMINO-D-GLUCITOL
Compound Number 27
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C42H50N2O9
InChI InChI=1S/C42H50N2O9/c1-29(46)43-37-41(51-27-33-20-12-5-13-21-33)40(50-26-32-18-10-4-11-19-32)36(28-49-25-31-16-8-3-9-17-31)52-42(37)53-39-34(24-45)44(23-35(47)38(39)48)22-30-14-6-2-7-15-30/h2-21,34-42,45,47-48H,22-28H2,1H3,(H,43,46)/t34-,35+,36-,37-,38-,39-,40+,41-,42+/m1/s1
InChIKey HGTYYTKVOGOFQD-MGJWTMGOSA-N
Literature Reference Author L.GUAZZELLO,G.CATELANI,F.DANDREA,T.GRAGNANI,A.GRISELI
Literature Reference Citation EUR.J.ORG.CHEM.,2014,6527(2014)
Literature Reference DOI 10.1002/ejoc.201402555
Molecular Weight 726.867 g/mol
Solvent CD3CN
Source File Reference UWLU85429