| SpectraBase Compound ID | H580z9jQWbj |
|---|---|
| InChI | InChI=1S/2C23H23BrClN2O10P/c2*1-13(28)2-5-21(29)36-18-9-20(27-10-14(6-7-24)22(30)26-23(27)31)35-19(18)12-34-38(32)33-11-15-8-16(25)3-4-17(15)37-38/h2*3-4,6-8,10,18-20H,2,5,9,11-12H2,1H3,(H,26,30,31)/b2*7-6+/t2*18-,19+,20+,38?/m00/s1 |
| InChIKey | ZJBMOTZGBRGCPL-VPRPCKFMSA-N |
| Mol Weight | 1267.54 g/mol |
| Molecular Formula | C46H46Br2Cl2N4O20P2 |
| Exact Mass | 1263.992445 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JnsQ19KmHWu |
|---|---|
| Name | CYCLO-(5-CHLOROSALIGENYL)-5'-O-(E)-5-(2-BROMOVINYL)-3'-O-LEVULINYL-(2'-DEOXYURIDINYL)-PHOSPHATE;5-CL-CYCLO-SAL-3'-O-LEV-BVDUMP |
| Compound Number | 6A |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C46H46Br2Cl2N4O20P2 |
| InChI | InChI=1S/2C23H23BrClN2O10P/c2*1-13(28)2-5-21(29)36-18-9-20(27-10-14(6-7-24)22(30)26-23(27)31)35-19(18)12-34-38(32)33-11-15-8-16(25)3-4-17(15)37-38/h2*3-4,6-8,10,18-20H,2,5,9,11-12H2,1H3,(H,26,30,31)/b2*7-6+/t2*18-,19+,20+,38?/m00/s1 |
| InChIKey | ZJBMOTZGBRGCPL-VPRPCKFMSA-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 | 1267.548 g/mol |
| Sample ID | 65632 |
| Solvent | CDCl3 |