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[(2S)-2-HYDROXY-3-(6-AMINO-9H-PURIN-9-YL)-PROPYL]-3,4-DI-O-BENZOYL-2-O-BENZYL-ALPHA-D-XYLOPYRANOSIDE
SpectraBase Compound ID A1Lxe4hcVjE
InChI InChI=1S/C34H33N5O8/c35-30-27-31(37-20-36-30)39(21-38-27)16-25(40)18-44-34-29(43-17-22-10-4-1-5-11-22)28(47-33(42)24-14-8-3-9-15-24)26(19-45-34)46-32(41)23-12-6-2-7-13-23/h1-15,20-21,25-26,28-29,34,40H,16-19H2,(H2,35,36,37)/t25-,26+,28-,29+,34-/m1/s1
InChIKey ADNZBIXRKWAHJP-ZUDNAMTBSA-N
Mol Weight 639.7 g/mol
Molecular Formula C34H33N5O8
Exact Mass 639.232913 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID C0S44M9pRK5
Name [(2S)-2-HYDROXY-3-(6-AMINO-9H-PURIN-9-YL)-PROPYL]-3,4-DI-O-BENZOYL-2-O-BENZYL-ALPHA-D-XYLOPYRANOSIDE
Compound Number 38
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C34H33N5O8
InChI InChI=1S/C34H33N5O8/c35-30-27-31(37-20-36-30)39(21-38-27)16-25(40)18-44-34-29(43-17-22-10-4-1-5-11-22)28(47-33(42)24-14-8-3-9-15-24)26(19-45-34)46-32(41)23-12-6-2-7-13-23/h1-15,20-21,25-26,28-29,34,40H,16-19H2,(H2,35,36,37)/t25-,26+,28-,29+,34-/m1/s1
InChIKey ADNZBIXRKWAHJP-ZUDNAMTBSA-N
Literature Reference Author F.ROUSSEL,N.MOITESSIER,M.HILLY,F.CHRETIEN,J.P.MAUGER,Y.CHAPL EUR
Literature Reference Citation BIOORG.MED.CHEM.,10,759(2002)
Literature Reference DOI 10.1016/S0968-0896(01)00329-7
Molecular Weight 639.665 g/mol
Solvent CDCl3
Source File Reference UWLU30957