![N-[5'-O-(4,4'-DIMETHOXYTRITYL)-3'-AMINO-3'-DEOXYTHYMIDIN-3'-YL]-O-(3'-O-ACETYLTHYMIDIN-5'-YL)-METHANEPHOSPHONAMIDATE;FAST](/api/spectrum/Ddl6dlh2SLC/structure.png?h=300&w=458 "N-[5'-O-(4,4'-DIMETHOXYTRITYL)-3'-AMINO-3'-DEOXYTHYMIDIN-3'-YL]-O-(3'-O-ACETYLTHYMIDIN-5'-YL)-METHANEPHOSPHONAMIDATE;FAST")
| SpectraBase Compound ID | 41FX3zgfQpb |
|---|---|
| InChI | InChI=1S/C44H50N5O13P/c1-26-22-48(42(53)45-40(26)51)38-20-34(47-63(6,55)59-25-37-35(60-28(3)50)21-39(62-37)49-23-27(2)41(52)46-43(49)54)36(61-38)24-58-44(29-10-8-7-9-11-29,30-12-16-32(56-4)17-13-30)31-14-18-33(57-5)19-15-31/h7-19,22-23,34-39H,20-21,24-25H2,1-6H3,(H,47,55)(H,45,51,53)(H,46,52,54)/t34-,35-,36+,37+,38+,39+,63?/m0/s1 |
| InChIKey | GEYCWHQIUAGBKF-DFMHVPIKSA-N |
| Mol Weight | 887.9 g/mol |
| Molecular Formula | C44H50N5O13P |
| Exact Mass | 887.314274 g/mol |
31P Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Ddl6dlh2SLC |
|---|---|
| Name | N-[5'-O-(4,4'-DIMETHOXYTRITYL)-3'-AMINO-3'-DEOXYTHYMIDIN-3'-YL]-O-(3'-O-ACETYLTHYMIDIN-5'-YL)-METHANEPHOSPHONAMIDATE;SLOW |
| Compound Number | 5AA |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C44H50N5O13P |
| InChI | InChI=1S/C44H50N5O13P/c1-26-22-48(42(53)45-40(26)51)38-20-34(47-63(6,55)59-25-37-35(60-28(3)50)21-39(62-37)49-23-27(2)41(52)46-43(49)54)36(61-38)24-58-44(29-10-8-7-9-11-29,30-12-16-32(56-4)17-13-30)31-14-18-33(57-5)19-15-31/h7-19,22-23,34-39H,20-21,24-25H2,1-6H3,(H,47,55)(H,45,51,53)(H,46,52,54)/t34-,35-,36+,37+,38+,39+,63?/m0/s1 |
| InChIKey | GEYCWHQIUAGBKF-DFMHVPIKSA-N |
| Literature Reference Author | B.NAWROT,M.SOBCZAK,S.ANTOSZCZYK |
| Literature Reference Citation | ORG.LETTERS,4,1799(2002) |
| Literature Reference DOI | 10.1021/ol0259084 |
| Solvent | CDCl3 |
| Source File Reference | UWVN33565 |