(1R,2S,3S,4R,5S)-1-(乙酰氧甲基)-5-(4-氯-3-(4-乙氧苄基)苯基)-6,8-二氧杂双环[3.2.1]辛烷-2,3,4-三乙酸三酯 基本信息
| 中文名称 | (1R,2S,3S,4R,5S)-1-(乙酰氧甲基)-5-(4-氯-3-(4-乙氧苄基)苯基)-6,8-二氧杂双环[3.2.1]辛烷-2,3,4-三乙酸三酯 |
|---|---|
| 中文同义词 | (1R,2S,3S,4R,5S)-1-(乙酰氧甲基)-5-(4-氯-3-(4-乙氧苄基)苯基)-6,8-二氧杂双环[3.2.1]辛烷-2,3,4-三乙酸三酯;5-C-[(乙酰氧基)甲基]-1,6-脱水-1-C-[4-氯-3-[(4-乙氧基苯基)甲基]苯基]-BETA-L-吡喃艾杜糖 2,3,4-三乙酸酯;埃格列净杂质4;埃格列净杂质5;埃格列净杂质05;艾图格列嗪杂质4;艾托格列净乙酰基杂质;艾托格列净杂质PF-05029508 |
| 英文名称 | (1R,2S,3S,4R,5S)-1-(acetoxymethyl)-5-(4-chloro-3-(4-ethoxybenzyl)phenyl)-6,8-dioxabicyclo[3.2.1]octane-2,3,4-triyltriacetate |
| 英文同义词 | Ertugliflozin Impuity 4;(1R,2S,3S,4R,5S)-1-(acetoxymethyl)-5-(4-chloro-3-(4-ethoxybenzyl)phenyl)-6,8-dioxabicyclo[3.2.1]octane-2,3,4-triyltriacetate;EOS-60361;5-C-[(Acetyloxy)methyl]-1,6-anhydro-1-C-[4-chloro-3-[(4-ethoxyphenyl)methyl]phenyl]-beta-L-idopyranose 2,3,4-triacetate;(1R,2S,3S,4R,5S)-1-(acetoxymethyl)-5-(4-chloro-3-(4-ethoxybenzyl)phenyl)-6,8-dioxabicyclo[3.2.1]octa;Ertugliflozin Impurity 4;β-L-Idopyranose, 5-C-[(acetyloxy)methyl]-1,6-anhydro-1-C-[4-chloro-3-[(4-ethoxyphenyl)methyl]phenyl]-, 2,3,4-triacetate;Ertugliflozin Tetraacetate |
| CAS号 | 1298086-18-6 |
| 分子式 | C30H33ClO11 |
| 分子量 | 605.03 |
| EINECS号 | |
| 相关类别 | 系列1 |
| Mol文件 | 1298086-18-6.mol |
| 结构式 | ![(1R,2S,3S,4R,5S)-1-(乙酰氧甲基)-5-(4-氯-3-(4-乙氧苄基)苯基)-6,8-二氧杂双环[3.2.1]辛烷-2,3,4-三乙酸三酯 结构式](CAS/20180703/GIF/1298086-18-6.gif) |
(1R,2S,3S,4R,5S)-1-(乙酰氧甲基)-5-(4-氯-3-(4-乙氧苄基)苯基)-6,8-二氧杂双环[3.2.1]辛烷-2,3,4-三乙酸三酯 性质
| 沸点 | 633.3±55.0 °C(Predicted) |
|---|---|
| 密度 | 1.35±0.1 g/cm3(Predicted) |
| InChIKey | LFZVLROKLDGLRV-VTMVYQAFNA-N |
| SMILES | [C@]12(COC(C)=O)O[C@](C3=CC=C(Cl)C(CC4=CC=C(OCC)C=C4)=C3)(OC1)[C@H](OC(=O)C)[C@@H](OC(=O)C)[C@@H]2OC(=O)C |&1:0,7,27,32,37,r| |