![[S-(P)]-5'-O-(4,4'-DIMETHOXYTRITYL)-3'-O-ACETYL-DITHYMIDINE-3',5'-METHANEPHOSPHONATE](/api/spectrum/8cy3D0xqDmN/structure.png?h=300&w=458 "[S-(P)]-5'-O-(4,4'-DIMETHOXYTRITYL)-3'-O-ACETYL-DITHYMIDINE-3',5'-METHANEPHOSPHONATE")
| SpectraBase Compound ID | 3BpeQX8fh3e |
|---|---|
| InChI | InChI=1S/C54H65N4O18P/c1-30-24-57(52(64)55-50(30)62)48-20-38(44(26-59)74-48)40-22-42(71-32(3)61)47(73-40)29-70-77(6,66)76-43-23-41(39-21-49(75-45(39)27-60)58-25-31(2)51(63)56-53(58)65)72-46(43)28-69-54(33-10-8-7-9-11-33,34-12-16-36(67-4)17-13-34)35-14-18-37(68-5)19-15-35/h7-19,24-25,38-49,59-60H,20-23,26-29H2,1-6H3,(H,55,62,64)(H,56,63,65)/t38-,39+,40-,41-,42+,43+,44-,45+,46-,47-,48-,49+,77?/m1/s1 |
| InChIKey | CGWGCMISTDEPJH-SZVSECGVSA-N |
| Mol Weight | 1089.1 g/mol |
| Molecular Formula | C54H65N4O18P |
| Exact Mass | 1088.403148 g/mol |
31P Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 8cy3D0xqDmN |
|---|---|
| Name | [S-(P)]-5'-O-(4,4'-DIMETHOXYTRITYL)-3'-O-ACETYL-DITHYMIDINE-3',5'-METHANEPHOSPHONATE |
| Compound Number | 4 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C54H65N4O18P |
| InChI | InChI=1S/C54H65N4O18P/c1-30-24-57(52(64)55-50(30)62)48-20-38(44(26-59)74-48)40-22-42(71-32(3)61)47(73-40)29-70-77(6,66)76-43-23-41(39-21-49(75-45(39)27-60)58-25-31(2)51(63)56-53(58)65)72-46(43)28-69-54(33-10-8-7-9-11-33,34-12-16-36(67-4)17-13-34)35-14-18-37(68-5)19-15-35/h7-19,24-25,38-49,59-60H,20-23,26-29H2,1-6H3,(H,55,62,64)(H,56,63,65)/t38-,39+,40-,41-,42+,43+,44-,45+,46-,47-,48-,49+,77?/m1/s1 |
| InChIKey | CGWGCMISTDEPJH-SZVSECGVSA-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 | UWSI25960 |