5-碘-1-(2,3,5-三-O-乙酰基-BETA-D-阿拉伯呋喃糖基)-2,4(1H,3H)-嘧啶二酮 基本信息
| 中文名称 | 5-碘-1-(2,3,5-三-O-乙酰基-BETA-D-阿拉伯呋喃糖基)-2,4(1H,3H)-嘧啶二酮 |
|---|---|
| 中文同义词 | 5-碘-1-(2,3,5-三-O-乙酰基-BETA-D-阿拉伯呋喃糖基)-2,4(1H,3H)-嘧啶二酮 |
| 英文名称 | 5-Iodo-2',3',5'-tri-O-acetyluridine |
| 英文同义词 | 5-Iodo-2',3',5'-tri-O-acetyluridine;5-Iodo-1-(2,3,5-tri-O-acetyl-beta-D-arabinofuranosyl)-2,4(1H,3H)-pyrimidinedione;2',3',5'-Tri-O-acetyl-5-iodouridine;(2R,3R,4R,5R)-2-(Acetoxymethyl)-5-(5-iodo-2,4-dioxo-3,4-dihydropyrimidin-1(2h)-yl)tetrahydrofuran-3,4-diyl diacetate;2,4(1H,3H)-Pyrimidinedione, 5-iodo-1-(2,3,5-tri-O-acetyl-β-D-arabinofuranosyl)- |
| CAS号 | 84500-33-4 |
| 分子式 | C15H17IN2O9 |
| 分子量 | 496.20795 |
| EINECS号 | |
| 相关类别 | 核苷 |
| Mol文件 | 84500-33-4.mol |
| 结构式 |  |
5-碘-1-(2,3,5-三-O-乙酰基-BETA-D-阿拉伯呋喃糖基)-2,4(1H,3H)-嘧啶二酮 性质
| 熔点 | 184-186 °C |
|---|---|
| 密度 | 1.79±0.1 g/cm3(Predicted) |
| 酸度系数(pKa) | 7.94±0.10(Predicted) |
| InChI | InChI=1/C15H17IN2O9/c1-6(19)24-5-10-11(25-7(2)20)12(26-8(3)21)14(27-10)18-4-9(16)13(22)17-15(18)23/h4,10-12,14H,5H2,1-3H3,(H,17,22,23)/t10-,11-,12-,14-/s3 |
| InChIKey | WPIWKTDTMIYODW-VVZDBYJNNA-N |
| SMILES | O(C(C)=O)C[C@H]1O[C@@H](N2C=C(I)C(=O)NC2=O)[C@H](OC(C)=O)[C@@H]1OC(C)=O |&1:5,7,17,22,r| |