| SpectraBase Compound ID | 8iKGEYh8rbz |
|---|---|
| InChI | InChI=1S/2C24H29BrN3O9P/c2*1-13(2)20(26)23(30)36-17-9-19(28-10-15(7-8-25)22(29)27-24(28)31)35-18(17)12-34-38(32)33-11-16-6-4-5-14(3)21(16)37-38/h2*4-8,10,13,17-20H,9,11-12,26H2,1-3H3,(H,27,29,31)/b2*8-7+/t2*17-,18+,19+,20-,38?/m11/s1 |
| InChIKey | MUEUCDJMOSSSRB-PSENOZKKSA-N |
| Mol Weight | 1228.77 g/mol |
| Molecular Formula | C48H58Br2N6O18P2 |
| Exact Mass | 1226.164959 g/mol |
31P Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | HDKmCaTQ4J5 |
|---|---|
| Name | CYCLO-(3-METHYLSALIGENYL)-5'-O-(E)-5-(2-BROMOVINYL)-(2'-DEOXY-3'-O-D-VALYNYLURIDINYL)-PHOSPHATE;3-ME-CYCLO-3'-O-D-VAL-BVDUMP |
| Compound Number | 4E |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C48H58Br2N6O18P2 |
| InChI | InChI=1S/2C24H29BrN3O9P/c2*1-13(2)20(26)23(30)36-17-9-19(28-10-15(7-8-25)22(29)27-24(28)31)35-18(17)12-34-38(32)33-11-16-6-4-5-14(3)21(16)37-38/h2*4-8,10,13,17-20H,9,11-12,26H2,1-3H3,(H,27,29,31)/b2*8-7+/t2*17-,18+,19+,20-,38?/m11/s1 |
| InChIKey | MUEUCDJMOSSSRB-PSENOZKKSA-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 |
| Solvent | DMSO-D6 |
| Source File Reference | UWLU65654 |