![N4-BENZOYL-1-[(2R,4R,5R)-4-ACETYLTHIOMETHYL-5-(2-TERT.-BUTYLDIPHENYLSILYLOXYETHYL)-TETRAHYDROFURAN-2-YL]-CYTOSINE](/api/spectrum/4xQx7bGqjjI/structure.png?h=300&w=458 "N4-BENZOYL-1-[(2R,4R,5R)-4-ACETYLTHIOMETHYL-5-(2-TERT.-BUTYLDIPHENYLSILYLOXYETHYL)-TETRAHYDROFURAN-2-YL]-CYTOSINE")
| SpectraBase Compound ID | usKXxsd8ej |
|---|---|
| InChI | InChI=1S/C36H41N3O5SSi/c1-26(40)45-25-28-24-33(39-22-20-32(38-35(39)42)37-34(41)27-14-8-5-9-15-27)44-31(28)21-23-43-46(36(2,3)4,29-16-10-6-11-17-29)30-18-12-7-13-19-30/h5-20,22,28,31,33H,21,23-25H2,1-4H3,(H,37,38,41,42)/t28-,31-,33-/m0/s1 |
| InChIKey | MGLJPUXPYMRBCX-APGVRMINSA-N |
| Mol Weight | 655.9 g/mol |
| Molecular Formula | C36H41N3O5SSi |
| Exact Mass | 655.253619 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4xQx7bGqjjI |
|---|---|
| Name | N4-BENZOYL-1-[(2R,4R,5R)-4-ACETYLTHIOMETHYL-5-(2-TERT.-BUTYLDIPHENYLSILYLOXYETHYL)-TETRAHYDROFURAN-2-YL]-CYTOSINE |
| Compound Number | 43 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C36H41N3O5SSi |
| InChI | InChI=1S/C36H41N3O5SSi/c1-26(40)45-25-28-24-33(39-22-20-32(38-35(39)42)37-34(41)27-14-8-5-9-15-27)44-31(28)21-23-43-46(36(2,3)4,29-16-10-6-11-17-29)30-18-12-7-13-19-30/h5-20,22,28,31,33H,21,23-25H2,1-4H3,(H,37,38,41,42)/t28-,31-,33-/m0/s1 |
| InChIKey | MGLJPUXPYMRBCX-APGVRMINSA-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 | 655.884 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWLU26105 |