![2-CHLORO-9-[2-DEOXY-5-O-[(1,1-DIMETHYLETHYL)-DIPHENYLSILYL]-3-O-(PHENOXYTHIOCARBONYL)-BETA-D-ERYTHRO-PENTOFURANOSYL]-9H-PURIN-6-AMINE](/api/spectrum/2ehA7pw2DiR/structure.png?h=300&w=458 "2-CHLORO-9-[2-DEOXY-5-O-[(1,1-DIMETHYLETHYL)-DIPHENYLSILYL]-3-O-(PHENOXYTHIOCARBONYL)-BETA-D-ERYTHRO-PENTOFURANOSYL]-9H-PURIN-6-AMINE")
| SpectraBase Compound ID | C0u39NfNmaI |
|---|---|
| InChI | InChI=1S/C33H34ClN5O4SSi/c1-33(2,3)45(23-15-9-5-10-16-23,24-17-11-6-12-18-24)40-20-26-25(43-32(44)41-22-13-7-4-8-14-22)19-27(42-26)39-21-36-28-29(35)37-31(34)38-30(28)39/h4-18,21,25-27H,19-20H2,1-3H3,(H2,35,37,38)/t25-,26+,27+/m1/s1 |
| InChIKey | KRAAKIRFEUTWHI-PVHODMMVSA-N |
| Mol Weight | 660.3 g/mol |
| Molecular Formula | C33H34ClN5O4SSi |
| Exact Mass | 659.17893 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2ehA7pw2DiR |
|---|---|
| Name | 2-CHLORO-9-[2-DEOXY-5-O-[(1,1-DIMETHYLETHYL)-DIPHENYLSILYL]-3-O-(PHENOXYTHIOCARBONYL)-BETA-D-ERYTHRO-PENTOFURANOSYL]-9H-PURIN-6-AMINE |
| Compound Number | 11A |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C33H34ClN5O4SSi |
| InChI | InChI=1S/C33H34ClN5O4SSi/c1-33(2,3)45(23-15-9-5-10-16-23,24-17-11-6-12-18-24)40-20-26-25(43-32(44)41-22-13-7-4-8-14-22)19-27(42-26)39-21-36-28-29(35)37-31(34)38-30(28)39/h4-18,21,25-27H,19-20H2,1-3H3,(H2,35,37,38)/t25-,26+,27+/m1/s1 |
| InChIKey | KRAAKIRFEUTWHI-PVHODMMVSA-N |
| Literature Reference Author | F.SEELA,B.GABLER |
| Literature Reference Citation | HELV.CHIM.ACTA,77,622(1994) |
| Literature Reference DOI | 10.1002/hlca.19940770305 |
| Molecular Weight | 660.263 g/mol |
| Solvent | DMSO-D6 |
| Source File Reference | UWVP4033 |