9-[5-[3-[3,5-Dihydroxy-6-(hydroxymethyl)-4-(3,4,5-trihydroxyoxan-2-yl)oxyoxan-2-yl]oxy-5-hydroxy-6-(hydroxymethyl)-4-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-3,4-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1,5',11a,13a-tetramethylspiro[1,3a,4,5,5a,5b,6,7,7a,8,9,10,11,11b,12,13b-hexadecahydrophenanthro[2,1-e][1]benzofuran-2,2'-oxane]-13-one

• 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: 9-[5-[3-[3,5-Dihydroxy-6-(hydroxymethyl)-4-(3,4,5-trihydroxyoxan-2-yl)oxyoxan-2-yl]oxy-5-hydroxy-6-(hydroxymethyl)-4-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-3,4-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1,5',11a,13a-tetramethylspiro[1,3a,4,5,5a,5b,6,7,7a,8,9,10,11,11b,12,13b-hexadecahydrophenanthro[2,1-e][1]benzofuran-2,2'-oxane]-13-one
• 英文别名: 9-[5-[3-[3,5-dihydroxy-6-(hydroxymethyl)-4-(3,4,5-trihydroxyoxan-2-yl)oxyoxan-2-yl]oxy-5-hydroxy-6-(hydroxymethyl)-4-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-3,4-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1,5',11a,13a-tetramethylspiro[1,3a,4,5,5a,5b,6,7,7a,8,9,10,11,11b,12,13b-hexadecahydrophenanthro[2,1-e][1]benzofuran-2,2'-oxane]-13-one
• 化学式: C₅₇H₉₂O₂₈
• 分子量: 1225.3
• InChiKey: UPVHTSJSZFWMJI-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  -3.3
• 重原子数：
  85
• 可旋转键数：
  14
• 环数：
  11.0
• sp3杂化的碳原子比例：
  0.98
• 拓扑面积：
  431
• 氢给体数：
  15
• 氢受体数：
  28