Esculentoside H
概要:Esculentoside H(CAS 66656-92-6)是一种化学化合物,分子式为C48H76O21,分子量为988.49 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。
2-O-methyl 4a-O-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] (2R,4aR,6aR,6aS,6bR,9R,10R,11S,12aR,14bR)-10-[(2S,3R,4R,5R)-3,4-dihydroxy-5-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-11-hydroxy-9-(hydroxymethyl)-2,6a,6b,9,12a-pentamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-2,4a-dicarboxylate
又称:Esculentoside H, EsculentosideH, 2-O-methyl 4a-O-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] (2R,4aR,6aR,6aS,6bR,9R,10R,11S,12aR,14bR)-10-[(2S,3R,4R,5R)-3,4-dihydroxy-5-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-11-hydroxy-9-(hydroxymethyl)-2,6a,6b,9,12a-pentamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-2,4a-dicarboxylate, 3-O-(beta-D-Glucopyranosyl-(1-4)-beta-D-xylopyranosyl)-28-O-beta-D-glucopyranosylphytolaccagenin, 2-methyl 4a-(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl (2R,4aR,6aS,6bR,9R,10R,11S,12aR,12bR,14bR)-10-{[(2S,3R,4R,5R)-3,4-dihydroxy-5-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-2-yl]oxy}-11-hydroxy-9-(hydroxymethyl)-2,6a,6b,9,12a-pentamethyl-1,3,4,5,6,7,8,8a,10,11,12,12b,13,14b-tetradecahydropicene-2,4a-dicarboxylate
| 分子式 | C48H76O21 |
|---|---|
| 分子量 | 988.49 g/mol |
| LogP | -2.1241 |
| 拓扑极性表面积 | 341.51 Ų |
| 氢键供体数 | 12 |
| 氢键受体数 | 21 |
| 可旋转键数 | 10 |
| 精确质量 | 988.4879 |
| 重原子数 | 69 |
| 复杂度 | 1919.8765 |
化学标识符
| CAS 编号 | 66656-92-6 |
|---|---|
| SMILES | C[C@]1(CC[C@@]2(CC[C@@]3(C(=CC[C@H]4[C@]3(CCC5[C@@]4(C[C@@H]([C@@H]([C@@]5(C)CO)O[C@H]6[C@@H]([C@H]([C@@H](CO6)O[C@H]7[C@@H]([C@H]([C@@H]([C@H](O7)CO)O)O)O)O)O)O)C)C)[C@H]2C1)C)C(=O)O[C@H]8[C@@H]([C@H]([C@@H]([C@H](O8)CO)O)O)O)C(=O)OC |
产品概述
Esculentoside H(CAS 66656-92-6),分子式为C48H76O21,分子量为988.49 g/mol。IUPAC名:2-O-methyl 4a-O-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] (2R,4aR,6aR,6aS,6bR,9R,10R,11S,12aR,14bR)-10-[(2S,3R,4R,5R)-3,4-dihydroxy-5-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-11-hydroxy-9-(hydroxymethyl)-2,6a,6b,9,12a-pentamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-2,4a-dicarboxylate。
Esculentoside H化学性质概览
属性洞察:Esculentoside H
Esculentoside H的XLogP值为-2.1241,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341.51 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,Esculentoside H有12个氢键供体和21个氢键受体,可能需要考虑配方优化。
常见问题
常见问题
Esculentoside H的CAS号是多少?
Esculentoside H的CAS号为66656-92-6。
Esculentoside H的分子式是什么?
Esculentoside H的分子式为C48H76O21。
Esculentoside H的分子量是多少?
Esculentoside H的分子量为988.49 g/mol。
在哪里可以购买Esculentoside H?
您可以直接向科弘生物询价Esculentoside H。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Esculentoside H的定制合成服务?
是的,科弘生物提供Esculentoside H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。