5-[[6-[[17-(2,6-Dihydroxy-6-methylhept-4-en-2-yl)-4,4,9,13,14-pentamethyl-11-oxo-1,2,3,7,8,10,12,15,16,17-decahydrocyclopenta[a]phenanthren-3-yl]oxy]-3,4-dihydroxy-5-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxyoxan-2-yl]methoxy]-3-hydroxy-3-methyl-5-oxopentanoic acid

• 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: 5-[[6-[[17-(2,6-Dihydroxy-6-methylhept-4-en-2-yl)-4,4,9,13,14-pentamethyl-11-oxo-1,2,3,7,8,10,12,15,16,17-decahydrocyclopenta[a]phenanthren-3-yl]oxy]-3,4-dihydroxy-5-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxyoxan-2-yl]methoxy]-3-hydroxy-3-methyl-5-oxopentanoic acid
• 英文别名: 5-[[6-[[17-(2,6-dihydroxy-6-methylhept-4-en-2-yl)-4,4,9,13,14-pentamethyl-11-oxo-1,2,3,7,8,10,12,15,16,17-decahydrocyclopenta[a]phenanthren-3-yl]oxy]-3,4-dihydroxy-5-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxyoxan-2-yl]methoxy]-3-hydroxy-3-methyl-5-oxopentanoic acid
• 化学式: C₄₈H₇₆O₁₇
• 分子量: 925.1
• InChiKey: QHNUTPIUYCONRY-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  0.6
• 重原子数：
  65
• 可旋转键数：
  15
• 环数：
  6.0
• sp3杂化的碳原子比例：
  0.85
• 拓扑面积：
  279
• 氢给体数：
  9
• 氢受体数：
  17