维帕他韦中间体 N-3结构式
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常用名 | 维帕他韦中间体 N-3 | 英文名 | (2R,4R)-1-tert-butyl 2-(2-(9-((2S,5S)-1-((S)-2-(methoxycarbonylamino)-3-methylbutanoyl)-5-methylpyrrolidine-2-carbonyloxy)-8-oxo-8,9,10,11-tetrahydro-5H-dibenzo[c,g]chromen-3-yl)-2-oxoethyl) 4-(methoxymethyl)pyrrolidine-1,2-dicarboxylate |
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| CAS号 | 1378391-43-5 | 分子量 | 833.920 | |
| 密度 | 1.3±0.1 g/cm3 | 沸点 | 963.0±65.0 °C at 760 mmHg | |
| 分子式 | C44H55N3O13 | 熔点 | N/A | |
| MSDS | N/A | 闪点 | 536.2±34.3 °C |
| 中文名 | 维帕他韦中间体 N-3 |
|---|---|
| 英文名 | (2R,4R)-1-tert-butyl 2-(2-(9-((2S,5S)-1-((S)-2-(methoxycarbonylamino)-3-methylbutanoyl)-5-methylpyrrolidine-2-carbonyloxy)-8-oxo-8,9,10,11-tetrahydro-5H-dibenzo[c,g]chromen-3-yl)-2-oxoethyl) 4-(methoxymethyl)pyrrolidine-1,2-dicarboxylate |
| 英文别名 | 更多 |
| 密度 | 1.3±0.1 g/cm3 |
|---|---|
| 沸点 | 963.0±65.0 °C at 760 mmHg |
| 分子式 | C44H55N3O13 |
| 分子量 | 833.920 |
| 闪点 | 536.2±34.3 °C |
| 精确质量 | 833.373474 |
| PSA | 193.38000 |
| LogP | 5.19 |
| InChIKey | VIUSEVDFPVOBFC-UHFFFAOYSA-N |
| SMILES | COCC1CC(C(=O)OCC(=O)c2ccc3c(c2)COc2cc4c(cc2-3)CCC(OC(=O)C2CCC(C)N2C(=O)C(NC(=O)OC)C(C)C)C4=O)N(C(=O)OC(C)(C)C)C1 |
| 蒸汽压 | 0.0±0.3 mmHg at 25°C |
| 折射率 | 1.608 |
| Proline, N-(methoxycarbonyl)-L-valyl-5-methyl-, 3-[2-[(2S,4S)-2-carboxy-1-[(1,1-dimethylethoxy)carbonyl]-4-(methoxymethyl)-2-pyrrolidinyl]acetyl]-8,9,10,11-tetrahydro-8-oxo-5H-benzo[d]naphtho[2,3-b]pyran-9-yl ester, (5S)- |
| (2S,4S)-1-tert-butyl 2-(2-(9-((2S,5S)-1-((S)-2-(methoxycarbonylamino)-3-methylbutanoyl)-5-methylpyrrolidine-2-carbonyloxy)-8-oxo-8,9,10,11-tetrahydro-5H-dibenzo[c,g]chromen-3-yl)-2-oxoethyl) 4-(methoxymethyl)pyrrolidine-1,2-dicarboxylate |
| 3-{[(2S,4S)-2-Carboxy-4-(methoxymethyl)-1-{[(2-methyl-2-propanyl)oxy]carbonyl}-2-pyrrolidinyl]acetyl}-8-oxo-8,9,10,11-tetrahydro-5H-dibenzo[c,g]chromen-9-yl N-(methoxycarbonyl)-L-valyl-(5S)-5-methylprolinate |