| SpectraBase Compound ID | 2K4K4M1S5bW |
|---|---|
| InChI | InChI=1S/C22H32BrN3O8/c1-6-12(2)17(24-21(31)34-22(3,4)5)19(29)33-14-9-16(32-15(14)11-27)26-10-13(7-8-23)18(28)25-20(26)30/h7-8,10,12,14-17,27H,6,9,11H2,1-5H3,(H,24,31)(H,25,28,30)/b8-7+/t12-,14-,15+,16+,17-/m1/s1 |
| InChIKey | UTOJFHNXITYWCL-CNWYAOBTSA-N |
| Mol Weight | 546.4 g/mol |
| Molecular Formula | C22H32BrN3O8 |
| Exact Mass | 545.137278 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | qBYZBMiBW1 |
|---|---|
| Name | (E)-5-(2-BROMOVINYL)-3'-O-(N-BOC-D-ISOLEUCINYL)-2'-DEOXY-URIDINE |
| Compound Number | 5P |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C22H32BrN3O8 |
| InChI | InChI=1S/C22H32BrN3O8/c1-6-12(2)17(24-21(31)34-22(3,4)5)19(29)33-14-9-16(32-15(14)11-27)26-10-13(7-8-23)18(28)25-20(26)30/h7-8,10,12,14-17,27H,6,9,11H2,1-5H3,(H,24,31)(H,25,28,30)/b8-7+/t12-,14-,15+,16+,17-/m1/s1 |
| InChIKey | UTOJFHNXITYWCL-CNWYAOBTSA-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 | 546.415 g/mol |
| Sample ID | 65627 |
| Solvent | DMSO-D6 |