![N4-BENZOYL-1-[(2R,3R,4R,5R)-4-ACETYLTHIOMETHYL-5-(2-TERT.-BUTYLDIPHENYLSILYLOXYETHYL)-3-(1-IMIDAZOTHIOCARBONYLOXY)-TETRAHYDROFURAN-2-YL]-CYTOSINE](/api/spectrum/5aLz5djCc9t/structure.png?h=300&w=458 "N4-BENZOYL-1-[(2R,3R,4R,5R)-4-ACETYLTHIOMETHYL-5-(2-TERT.-BUTYLDIPHENYLSILYLOXYETHYL)-3-(1-IMIDAZOTHIOCARBONYLOXY)-TETRAHYDROFURAN-2-YL]-CYTOSINE")
| SpectraBase Compound ID | 2lyZ5kZ6Mh5 |
|---|---|
| InChI | InChI=1S/C40H43N5O7S2Si/c1-28(46)53-26-32-33(21-25-50-55(40(2,3)4,30-16-10-6-11-17-30)31-18-12-7-13-19-31)51-37(35(32)52-39(49)54-44-24-22-41-27-44)45-23-20-34(43-38(45)48)42-36(47)29-14-8-5-9-15-29/h5-20,22-24,27,32-33,35,37H,21,25-26H2,1-4H3,(H,42,43,47,48)/t32-,33-,35-,37-/m0/s1 |
| InChIKey | XXZKUOIPCPVDAZ-DWRSQNSDSA-N |
| Mol Weight | 798.0 g/mol |
| Molecular Formula | C40H43N5O7S2Si |
| Exact Mass | 797.237318 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5aLz5djCc9t |
|---|---|
| Name | N4-BENZOYL-1-[(2R,3R,4R,5R)-4-ACETYLTHIOMETHYL-5-(2-TERT.-BUTYLDIPHENYLSILYLOXYETHYL)-3-(1-IMIDAZOTHIOCARBONYLOXY)-TETRAHYDROFURAN-2-YL]-CYTOSINE |
| Compound Number | 41 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C40H43N5O7S2Si |
| InChI | InChI=1S/C40H43N5O7S2Si/c1-28(46)53-26-32-33(21-25-50-55(40(2,3)4,30-16-10-6-11-17-30)31-18-12-7-13-19-31)51-37(35(32)52-39(49)54-44-24-22-41-27-44)45-23-20-34(43-38(45)48)42-36(47)29-14-8-5-9-15-29/h5-20,22-24,27,32-33,35,37H,21,25-26H2,1-4H3,(H,42,43,47,48)/t32-,33-,35-,37-/m0/s1 |
| InChIKey | XXZKUOIPCPVDAZ-DWRSQNSDSA-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 | 798.016 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWLU26104 |