| SpectraBase Compound ID | AgYQs8upX0Y |
|---|---|
| InChI | InChI=1S/2C24H26BrN2O10P/c2*1-14-4-3-5-17-12-33-38(32,37-22(14)17)34-13-19-18(36-21(29)7-6-15(2)28)10-20(35-19)27-11-16(8-9-25)23(30)26-24(27)31/h2*3-5,8-9,11,18-20H,6-7,10,12-13H2,1-2H3,(H,26,30,31)/b2*9-8+/t2*18-,19+,20+,38?/m11/s1 |
| InChIKey | ZIBBMCDJPYBMJK-ITQMJKTFSA-N |
| Mol Weight | 1226.71 g/mol |
| Molecular Formula | C48H52Br2N4O20P2 |
| Exact Mass | 1224.10169 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | INLR2dbLY8 |
|---|---|
| Name | CYCLO-(3-METHYLSALIGENYL)-5'-O-(E)-5-(2-BROMOVINYL)-3'-O-LEVULINYL-(2'-DEOXYURIDINYL)-PHOSPHATE;3-ME-CYCLO-SAL-3'-O-LEV-BVDUMP |
| Compound Number | 3G |
| Copyright | Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C48H52Br2N4O20P2 |
| InChI | InChI=1S/2C24H26BrN2O10P/c2*1-14-4-3-5-17-12-33-38(32,37-22(14)17)34-13-19-18(36-21(29)7-6-15(2)28)10-20(35-19)27-11-16(8-9-25)23(30)26-24(27)31/h2*3-5,8-9,11,18-20H,6-7,10,12-13H2,1-2H3,(H,26,30,31)/b2*9-8+/t2*18-,19+,20+,38?/m11/s1 |
| InChIKey | ZIBBMCDJPYBMJK-ITQMJKTFSA-N |
| Literature Reference Author | C.MEIER,A.LOMP,A.MEERBACH,P.WUTZLER |
| Literature Reference Citation | J.MED.CHEM.,45,5157(2002) |
| Literature Reference DOI | 10.1021/jm0209275 |
| Molecular Weight | 1226.711 g/mol |
| Sample ID | 65649 |
| Solvent | CDCl3 |