[3-Benzoyloxy-5-hydroxy-2-[1-[14-hydroxy-3-[5-hydroxy-3-methoxy-6-methyl-4-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-10,13-dimethyl-1,2,3,4,7,8,9,11,12,15,16,17-dodecahydrocyclopenta[a]phenanthren-17-yl]ethoxy]-6-(hydroxymethyl)oxan-4-yl] benzoate

• 分子结构分类: 有机化合物 - 脂质和类脂质分子 - 类固醇和类固醇衍生物
• 英文名称: [3-Benzoyloxy-5-hydroxy-2-[1-[14-hydroxy-3-[5-hydroxy-3-methoxy-6-methyl-4-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-10,13-dimethyl-1,2,3,4,7,8,9,11,12,15,16,17-dodecahydrocyclopenta[a]phenanthren-17-yl]ethoxy]-6-(hydroxymethyl)oxan-4-yl] benzoate
• 英文别名: [3-benzoyloxy-5-hydroxy-2-[1-[14-hydroxy-3-[5-hydroxy-3-methoxy-6-methyl-4-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-10,13-dimethyl-1,2,3,4,7,8,9,11,12,15,16,17-dodecahydrocyclopenta[a]phenanthren-17-yl]ethoxy]-6-(hydroxymethyl)oxan-4-yl] benzoate
• 化学式: C₅₄H₇₄O₁₉
• 分子量: 1027.2
• InChiKey: MIHWBQGUIANIDQ-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.7
• 重原子数：
  73
• 可旋转键数：
  16
• 环数：
  9.0
• sp3杂化的碳原子比例：
  0.7
• 拓扑面积：
  279
• 氢给体数：
  8
• 氢受体数：
  19