![N4-BENZOYL-1-[(2R,3R,4R,5R)-4-ACETYLTHIOMETHYL-5-(2-TERT.-BUTYLDIPHENYLSILYLOXYETHYL)-3-HYDROXYTETRAHYDROFURAN-2-YL]-CYTOSINE](/api/spectrum/36mh7G5vFD1/structure.png?h=300&w=458 "N4-BENZOYL-1-[(2R,3R,4R,5R)-4-ACETYLTHIOMETHYL-5-(2-TERT.-BUTYLDIPHENYLSILYLOXYETHYL)-3-HYDROXYTETRAHYDROFURAN-2-YL]-CYTOSINE")
| SpectraBase Compound ID | GRxofXOEKoy |
|---|---|
| InChI | InChI=1S/C36H41N3O6SSi/c1-25(40)46-24-29-30(21-23-44-47(36(2,3)4,27-16-10-6-11-17-27)28-18-12-7-13-19-28)45-34(32(29)41)39-22-20-31(38-35(39)43)37-33(42)26-14-8-5-9-15-26/h5-20,22,29-30,32,34,41H,21,23-24H2,1-4H3,(H,37,38,42,43)/t29-,30-,32-,34-/m0/s1 |
| InChIKey | JMESEDMXMIHWDV-VIGXQUMASA-N |
| Mol Weight | 671.9 g/mol |
| Molecular Formula | C36H41N3O6SSi |
| Exact Mass | 671.248534 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 36mh7G5vFD1 |
|---|---|
| Name | N4-BENZOYL-1-[(2R,3R,4R,5R)-4-ACETYLTHIOMETHYL-5-(2-TERT.-BUTYLDIPHENYLSILYLOXYETHYL)-3-HYDROXYTETRAHYDROFURAN-2-YL]-CYTOSINE |
| Compound Number | 39 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C36H41N3O6SSi |
| InChI | InChI=1S/C36H41N3O6SSi/c1-25(40)46-24-29-30(21-23-44-47(36(2,3)4,27-16-10-6-11-17-27)28-18-12-7-13-19-28)45-34(32(29)41)39-22-20-31(38-35(39)43)37-33(42)26-14-8-5-9-15-26/h5-20,22,29-30,32,34,41H,21,23-24H2,1-4H3,(H,37,38,42,43)/t29-,30-,32-,34-/m0/s1 |
| InChIKey | JMESEDMXMIHWDV-VIGXQUMASA-N |
| Literature Reference Author | Z.HUANG,S.A.BENNER |
| Literature Reference Citation | J.ORG.CHEM.,67,3996(2002) |
| Literature Reference DOI | 10.1021/jo0003910 |
| Molecular Weight | 671.884 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWLU26103 |