| SpectraBase Compound ID | E1cosr6GGmC |
|---|---|
| InChI | InChI=1S/C47H60N3O15PSi2/c1-28(2)67(29(3)4)58-27-36-39(64-68(65-67,30(5)6)31(7)8)40(43(59-36)50-25-24-37(49-47(50)54)48-42(51)32-18-12-9-13-19-32)63-46-41(62-45(53)34-22-16-11-17-23-34)38(35(60-46)26-57-66(55)56)61-44(52)33-20-14-10-15-21-33/h9-25,28-31,35-36,38-41,43,46,66H,26-27H2,1-8H3,(H,55,56)(H,48,49,51,54)/t35-,36-,38-,39-,40-,41-,43-,46+/m1/s1 |
| InChIKey | WSSCHOQWXBJQEF-ZNTQXDTFSA-N |
| Mol Weight | 994.1 g/mol |
| Molecular Formula | C47H60N3O15PSi2 |
| Exact Mass | 993.330058 g/mol |
31P Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Eu7Xc7KiP43 |
|---|---|
| Name | 4-N-BENZOYL-3',5'-O-(TETRAISOPROPYLDISILOXANE-1,3-DIYL)-2'-O-(5''-H-PHOSPHONATE-2'',3''-DI-O-BENZOYL-BETA-D-RIBOFURANOSYL)-CYTIDINE |
| Compound Number | 4B |
| Copyright | Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C47H59N3O15PSi2 |
| InChI | InChI=1S/C47H60N3O15PSi2/c1-28(2)67(29(3)4)58-27-36-39(64-68(65-67,30(5)6)31(7)8)40(43(59-36)50-25-24-37(49-47(50)54)48-42(51)32-18-12-9-13-19-32)63-46-41(62-45(53)34-22-16-11-17-23-34)38(35(60-46)26-57-66(55)56)61-44(52)33-20-14-10-15-21-33/h9-25,28-31,35-36,38-41,43,46,66H,26-27H2,1-8H3,(H,55,56)(H,48,49,51,54)/t35-,36-,38-,39-,40-,41-,43-,46+/m1/s1 |
| InChIKey | WSSCHOQWXBJQEF-ZNTQXDTFSA-N |
| Literature Reference Author | M.K.CHMIELEWSKI,W.T.MARKIEWICZ |
| Literature Reference Citation | MOLECULES,18,14780(2013) |
| Literature Reference DOI | 10.3390/molecules181214780 |
| Solvent | D2O |
| Source File Reference | UWIR9924 |