![2-AMINO-9-[5_DIASTEREOMER2,3-DI-O-METHANESULFONYL-BETA-D-RIBOFURANOSYL]-6-METHOXYPURINE](/api/spectrum/CccMRPxpS19/structure.png?h=300&w=458 "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
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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 |