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2-AMINO-9-[5_DIASTEREOMER2,3-DI-O-METHANESULFONYL-BETA-D-RIBOFURANOSYL]-6-METHOXYPURINE
SpectraBase Compound ID H3Fqq9oL0gL
InChI InChI=1S/C29H37N5O9S2Si/c1-29(2,3)46(19-13-9-7-10-14-19,20-15-11-8-12-16-20)40-17-21-23(42-44(5,35)36)24(43-45(6,37)38)27(41-21)34-18-31-22-25(34)32-28(30)33-26(22)39-4/h7-16,18,21,23-24,27H,17H2,1-6H3,(H2,30,32,33)/t21-,23-,24-,27-/m0/s1
InChIKey RNYLXVBCVKDKRC-YQNORIIPSA-N
Mol Weight 691.8 g/mol
Molecular Formula C29H37N5O9S2Si
Exact Mass 691.180197 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CccMRPxpS19
Name 2-AMINO-9-[5_DIASTEREOMER2,3-DI-O-METHANESULFONYL-BETA-D-RIBOFURANOSYL]-6-METHOXYPURINE
Compound Number 11B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C29H37N5O9S2Si
InChI InChI=1S/C29H37N5O9S2Si/c1-29(2,3)46(19-13-9-7-10-14-19,20-15-11-8-12-16-20)40-17-21-23(42-44(5,35)36)24(43-45(6,37)38)27(41-21)34-18-31-22-25(34)32-28(30)33-26(22)39-4/h7-16,18,21,23-24,27H,17H2,1-6H3,(H2,30,32,33)/t21-,23-,24-,27-/m0/s1
InChIKey RNYLXVBCVKDKRC-YQNORIIPSA-N
Literature Reference Author M.J.ROBINS,E.LEWANDOWSKA,S.F.WNUK
Literature Reference Citation J.ORG.CHEM.,63,7375(1998)
Literature Reference DOI 10.1021/jo981013m
Molecular Weight 691.846 g/mol
Sample ID 26750
Solvent DMSO-D6