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2,5-ANHYDRO-3,4-DI-O-BENZYL-1-(2-BENZYLAMINO-6-PHENYLAMINO-9H-PURIN-9-YL)-1-DEOXY-D-GLUCITOL

View entire compound with spectra: 1 NMR

2,5-ANHYDRO-3,4-DI-O-BENZYL-1-(2-BENZYLAMINO-6-PHENYLAMINO-9H-PURIN-9-YL)-1-DEOXY-D-GLUCITOL
SpectraBase Compound ID 6VbjzOW3S1k
InChI InChI=1S/C38H38N6O4/c45-23-32-35(47-25-29-17-9-3-10-18-29)34(46-24-28-15-7-2-8-16-28)31(48-32)22-44-26-40-33-36(41-30-19-11-4-12-20-30)42-38(43-37(33)44)39-21-27-13-5-1-6-14-27/h1-20,26,31-32,34-35,45H,21-25H2,(H2,39,41,42,43)/t31-,32+,34+,35+/m0/s1
InChIKey LFIKCMAEDRTXRR-CUGVKSGVSA-N
Mol Weight 642.8 g/mol
Molecular Formula C38H38N6O4
Exact Mass 642.295454 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HViPdtFmw1Y
Name 2,5-ANHYDRO-3,4-DI-O-BENZYL-1-(2-BENZYLAMINO-6-PHENYLAMINO-9H-PURIN-9-YL)-1-DEOXY-D-GLUCITOL
Compound Number 23
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C38H38N6O4
InChI InChI=1S/C38H38N6O4/c45-23-32-35(47-25-29-17-9-3-10-18-29)34(46-24-28-15-7-2-8-16-28)31(48-32)22-44-26-40-33-36(41-30-19-11-4-12-20-30)42-38(43-37(33)44)39-21-27-13-5-1-6-14-27/h1-20,26,31-32,34-35,45H,21-25H2,(H2,39,41,42,43)/t31-,32+,34+,35+/m0/s1
InChIKey LFIKCMAEDRTXRR-CUGVKSGVSA-N
Literature Reference Author P.BUSCA,I.MCCORT,T.PRNGE,Y.L.MERRER
Literature Reference Citation EUR.J.ORG.CHEM.,2403(2006)
Molecular Weight 642.758 g/mol
Sample ID 44944
Solvent CDCl3