![N-[5'-O-(4,4'-DIMETHOXYTRITYL)-3'-AMINO-3'-DEOXYTHYMIDIN-3'-YL]-O-(THYMIDIN-5'-YL)-METHANEPHOSPHONAMIDATE;FAST](/api/spectrum/ALp2tjnnJoR/structure.png?h=300&w=458 "N-[5'-O-(4,4'-DIMETHOXYTRITYL)-3'-AMINO-3'-DEOXYTHYMIDIN-3'-YL]-O-(THYMIDIN-5'-YL)-METHANEPHOSPHONAMIDATE;FAST")
| SpectraBase Compound ID | 1BIh4C9j07j |
|---|---|
| InChI | InChI=1S/C42H48N5O12P/c1-25-21-46(40(51)43-38(25)49)36-19-32(45-60(5,53)57-24-35-33(48)20-37(59-35)47-22-26(2)39(50)44-41(47)52)34(58-36)23-56-42(27-9-7-6-8-10-27,28-11-15-30(54-3)16-12-28)29-13-17-31(55-4)18-14-29/h6-18,21-22,32-37,48H,19-20,23-24H2,1-5H3,(H,45,53)(H,43,49,51)(H,44,50,52)/t32-,33+,34+,35-,36+,37-,60?/m0/s1 |
| InChIKey | FTSLJAFDGFMFLM-ULEIUIHLSA-N |
| Mol Weight | 845.8 g/mol |
| Molecular Formula | C42H48N5O12P |
| Exact Mass | 845.303709 g/mol |
31P Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | ALp2tjnnJoR |
|---|---|
| Name | N-[5'-O-(4,4'-DIMETHOXYTRITYL)-3'-AMINO-3'-DEOXYTHYMIDIN-3'-YL]-O-(THYMIDIN-5'-YL)-METHANEPHOSPHONAMIDATE;SLOW |
| Compound Number | 12AA |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C42H48N5O12P |
| InChI | InChI=1S/C42H48N5O12P/c1-25-21-46(40(51)43-38(25)49)36-19-32(45-60(5,53)57-24-35-33(48)20-37(59-35)47-22-26(2)39(50)44-41(47)52)34(58-36)23-56-42(27-9-7-6-8-10-27,28-11-15-30(54-3)16-12-28)29-13-17-31(55-4)18-14-29/h6-18,21-22,32-37,48H,19-20,23-24H2,1-5H3,(H,45,53)(H,43,49,51)(H,44,50,52)/t32-,33+,34+,35-,36+,37-,60?/m0/s1 |
| InChIKey | FTSLJAFDGFMFLM-ULEIUIHLSA-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 | UWVN33567 |