![[S-(P)]-3'-O-ACETYL-DITHYMIDINE-3',5'-METHANEPHOSPHONATE](/api/spectrum/6Rbd6Wo2Lz6/structure.png?h=300&w=458 "[S-(P)]-3'-O-ACETYL-DITHYMIDINE-3',5'-METHANEPHOSPHONATE")
| SpectraBase Compound ID | 8r7pta3kysz |
|---|---|
| InChI | InChI=1S/C33H47N4O16P/c1-15-9-36(32(44)34-30(15)42)28-5-18(24(11-38)51-28)20-7-22(48-17(3)41)27(50-20)14-47-54(4,46)53-23-8-21(49-26(23)13-40)19-6-29(52-25(19)12-39)37-10-16(2)31(43)35-33(37)45/h9-10,18-29,38-40H,5-8,11-14H2,1-4H3,(H,34,42,44)(H,35,43,45)/t18-,19+,20-,21-,22+,23+,24-,25+,26-,27-,28-,29+,54?/m0/s1 |
| InChIKey | HMNOGVSZNQIMKI-SUDWXFHGSA-N |
| Mol Weight | 786.7 g/mol |
| Molecular Formula | C33H47N4O16P |
| Exact Mass | 786.272468 g/mol |
31P Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6Rbd6Wo2Lz6 |
|---|---|
| Name | [S-(P)]-3'-O-ACETYL-DITHYMIDINE-3',5'-METHANEPHOSPHONATE |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C33H47N4O16P |
| InChI | InChI=1S/C33H47N4O16P/c1-15-9-36(32(44)34-30(15)42)28-5-18(24(11-38)51-28)20-7-22(48-17(3)41)27(50-20)14-47-54(4,46)53-23-8-21(49-26(23)13-40)19-6-29(52-25(19)12-39)37-10-16(2)31(43)35-33(37)45/h9-10,18-29,38-40H,5-8,11-14H2,1-4H3,(H,34,42,44)(H,35,43,45)/t18-,19+,20-,21-,22+,23+,24-,25+,26-,27-,28-,29+,54?/m0/s1 |
| InChIKey | HMNOGVSZNQIMKI-SUDWXFHGSA-N |
| Literature Reference Author | J.PYZOWSKI,L.A.WOZNIAK,W.J.STEC |
| Literature Reference Citation | ORG.LETTERS,2,771(2000) |
| Literature Reference DOI | 10.1021/ol991376o |
| Solvent | Unknown |
| Source File Reference | UWSI25961 |