Mi-saponin A
概要：Mi-saponin A（CAS 54328-42-6）是一种化学化合物，分子式为C58H94O27，分子量为1222.60 g/mol。河南科弘生物科技有限公司提供CRO/CDMO定制合成服务，支持克级到吨级规格。
[(2S,3R,4S,5S)-3-[(2S,3R,4S,5R,6S)-5-[(2S,3R,4S,5R)-3,5-dihydroxy-4-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxy-3,4-dihydroxy-6-methyloxan-2-yl]oxy-4,5-dihydroxyoxan-2-yl] (4aS,6aR,6aS,6bR,8R,8aR,9R,10R,11S,12aR,14bS)-8,11-dihydroxy-9-(hydroxymethyl)-2,2,6a,6b,9,12a-hexamethyl-10-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylate
又称：Mi-saponin A, Mi-saponine A, [(2S,3R,4S,5S)-3-[(2S,3R,4S,5R,6S)-5-[(2S,3R,4S,5R)-3,5-dihydroxy-4-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxy-3,4-dihydroxy-6-methyloxan-2-yl]oxy-4,5-dihydroxyoxan-2-yl] (4aS,6aR,6aS,6bR,8R,8aR,9R,10R,11S,12aR,14bS)-8,11-dihydroxy-9-(hydroxymethyl)-2,2,6a,6b,9,12a-hexamethyl-10-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylate, ((2S,3R,4S,5S)-3-((2S,3R,4S,5R,6S)-5-((2S,3R,4S,5R)-3,5-dihydroxy-4-((2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl)oxyoxan-2-yl)oxy-3,4-dihydroxy-6-methyloxan-2-yl)oxy-4,5-dihydroxyoxan-2-yl) (4aS,6aR,6aS,6bR,8R,8aR,9R,10R,11S,12aR,14bS)-8,11-dihydroxy-9-(hydroxymethyl)-2,2,6a,6b,9,12a-hexamethyl-10-((2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl)oxy-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylate, (2S,3R,4R,5R)-3-(((2S,3R,4S,5S,6S)-5-(((2S,3R,4S,5R)-3,5-dihydroxy-4-(((2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl)oxy)oxan-2-yl)oxy)-3,4-dihydroxy-6-methyloxan-2-yl)oxy)-4,5-dihydroxyoxan-2-yl (4as,6as,6BR,8R,8ar,9R,10R,11S,12ar,12BR,14BS)-8,11-dihydroxy-9-(hydroxymethyl)-2,2,6a,6b,9,12a-hexamethyl-10-(((2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl)oxy)-1,2,3,4,4a,5,6,6a,6b,7,8,8a,9,10,11,12,12a,12b,13,14b-icosahydropicene-4a-carboxylic acid
| 分子式 | C58H94O27 |
|---|---|
| 分子量 | 1222.60 g/mol |
| LogP | -3.1 |
| 拓扑极性表面积 | 433.0 Ų |
| 氢键供体数 | 16 |
| 氢键受体数 | 27 |
| 可旋转键数 | 13 |
| 精确质量 | 1222.5983 |
| 重原子数 | 85 |
| 复杂度 | 2390.0 |
化学标识符
| CAS 编号 | 54328-42-6 |
|---|---|
| SMILES | C[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)O[C@H]2[C@@H](CO[C@H]([C@@H]2O)O[C@H]3[C@@H](O[C@H]([C@@H]([C@@H]3O)O)O[C@@H]4[C@H]([C@H](CO[C@H]4OC(=O)[C@@]56CC[C@@]7(C(=CC[C@H]8[C@]7(C[C@H]([C@@H]9[C@@]8(C[C@@H]([C@@H]([C@@]9(C)CO)O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O)O)C)O)C)[C@@H]5CC(CC6)(C)C)C)O)O)C)O)O)O)O |
| InChIKey | CQUSHZSCDGSFBF-NBHXUDFYSA-N |
产品概述
Mi-saponin A（CAS 54328-42-6），分子式为C58H94O27，分子量为1222.60 g/mol。IUPAC名：[(2S,3R,4S,5S)-3-[(2S,3R,4S,5R,6S)-5-[(2S,3R,4S,5R)-3,5-dihydroxy-4-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxy-3,4-dihydroxy-6-methyloxan-2-yl]oxy-4,5-dihydroxyoxan-2-yl] (4aS,6aR,6aS,6bR,8R,8aR,9R,10R,11S,12aR,14bS)-8,11-dihydroxy-9-(hydroxymethyl)-2,2,6a,6b,9,12a-hexamethyl-10-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylate。
Mi-saponin A化学性质概览
属性洞察：Mi-saponin A
Mi-saponin A的XLogP值为-3.1，表明该化合物具有亲水性（水溶性好），适合水性配方和生物检测应用。 TPSA为433.0 Ų，极性较高，提示该化合物膜透过性可能受限但水溶性较好。 根据Lipinski五规则，Mi-saponin A有16个氢键供体和27个氢键受体，可能需要考虑配方优化。
常见问题
常见问题
Mi-saponin A的CAS号是多少？
Mi-saponin A的CAS号为54328-42-6。
Mi-saponin A的分子式是什么？
Mi-saponin A的分子式为C58H94O27。
Mi-saponin A的分子量是多少？
Mi-saponin A的分子量为1222.60 g/mol。
在哪里可以购买Mi-saponin A？
您可以直接向科弘生物询价Mi-saponin A。联系我们或发送邮件至info@kehongbio.com获取报价和库存信息。
科弘生物是否提供Mi-saponin A的定制合成服务？
是的，科弘生物提供Mi-saponin A及相关化合物的定制合成服务。请联系我们并告知您的具体需求，包括数量、纯度和交期。