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[(2S)-3-(6-AMINO-9H-PURIN-9-YL)-2-HYDROXYPROPYL]-2-O-BENZYL-ALPHA-D-XYLOPYRANOSIDE
SpectraBase Compound ID LE7SGL23Lc4
InChI InChI=1S/C20H25N5O6/c21-18-15-19(23-10-22-18)25(11-24-15)6-13(26)8-30-20-17(16(28)14(27)9-31-20)29-7-12-4-2-1-3-5-12/h1-5,10-11,13-14,16-17,20,26-28H,6-9H2,(H2,21,22,23)/t13-,14+,16-,17+,20-/m1/s1
InChIKey IECRBJKHZQVDRA-BKFWEMOKSA-N
Mol Weight 431.45 g/mol
Molecular Formula C20H25N5O6
Exact Mass 431.180484 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JAKUQZVEX6y
Name [(2S)-3-(6-AMINO-9H-PURIN-9-YL)-2-HYDROXYPROPYL]-2-O-BENZYL-ALPHA-D-XYLOPYRANOSIDE
Compound Number 39
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H25N5O6
InChI InChI=1S/C20H25N5O6/c21-18-15-19(23-10-22-18)25(11-24-15)6-13(26)8-30-20-17(16(28)14(27)9-31-20)29-7-12-4-2-1-3-5-12/h1-5,10-11,13-14,16-17,20,26-28H,6-9H2,(H2,21,22,23)/t13-,14+,16-,17+,20-/m1/s1
InChIKey IECRBJKHZQVDRA-BKFWEMOKSA-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 431.448 g/mol
Solvent CD3OD
Source File Reference UWLU30958