奥贝胆酸中间体-3
| 中文名称 | 奥贝胆酸中间体-3 |
|---|---|
| 中文同义词 | 奥贝胆酸中间体-3;3A羟基-7氧代-胆烷酸甲酯;奥贝胆酸中间体;奥贝胆酸中间体F;奥贝胆酸中间体 N-2;3A羟基-7氧代-胆烷酸甲酸;奥贝中间体N-2;(E/Z)3A-羟基-6-乙烯基-7-氧代-24-胆甾烷酸 |
| 英文名称 | (E)-3α-hydroxy-6-ethylidene-7-keto-5β-cholan-24-oic acid |
| 英文同义词 | Obeticholic Acid-G;(3alpha,5beta,6E)-6-Ethylidene-3-hydroxy-7-oxocholan-24-oic acid;Obeticholic Acid N-5;(R)-methyl 4-((3R,5S,7R,10S,13R)-3,7-dihydroxy-10,13-dimethyl-hexadecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanoate;(R)-methyl 4-((3R,5S,8R,9S,10S,13R,14S,17R)-3-(tert-butyldimethylsilyloxy)-10,13-dimethyl-7-oxo-hexadecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanoate;(R)-methyl 4-((3R,7R,8R,9S,10S,13R,14S,17R)-3-(tert-butyldimethylsilyloxy)-7-hydroxy-10,13-dimethyl-hexadecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanoate;(R)-methyl 4-((3R,5S,8R,9S,10S,13R,14S,17R)-3-hydroxy-10,13-dimethyl-7-oxo-hexadecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanoate;Obeticholic Acid Intermediate 3 |
| CAS号 | 1516887-33-4 |
| 分子式 | C26H40O4 |
| 分子量 | 416.6 |
| EINECS号 | 811-949-2 |
| 相关类别 | 奥贝胆酸;奥贝胆酸中间体;医药中间体;杂质对照品;奥贝胆酸中三;胆酸;胆酸中间体;科研精品试剂;化学试剂;Ocaliva intermediate;Obeticholic acid intermediate;Intermediate |
| Mol文件 | 1516887-33-4.mol |
| 结构式 |  |
奥贝胆酸中间体-3 性质
| 沸点 | 573.1±43.0 °C(Predicted) |
|---|---|
| 密度 | 1.142±0.06 g/cm3(Predicted) |
| 储存条件 | Sealed in dry,Room Temperature |
| 酸度系数(pKa) | 4.76±0.10(Predicted) |
| InChIKey | RDCBMNFSJFALPG-QNLZCKQPNA-N |
| SMILES | C[C@]12CC[C@@H](O)C[C@@]1([H])/C(=C\C)/C(=O)[C@@]1([H])[C@]3([H])CC[C@]([H])([C@H](C)CCC(=O)O)[C@@]3(C)CC[C@]21[H] |&1:1,4,7,14,16,20,22,29,33,r| |