2-[2-[3',16-Dihydroxy-7,9,13-trimethyl-5'-methylidene-4'-(3,4,5-trihydroxyoxan-2-yl)spiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icos-18-ene-6,2'-oxane]-14-yl]oxy-5-hydroxy-6-methyl-3-(3,4,5-trihydroxyoxan-2-yl)oxyoxan-4-yl]oxy-6-methyloxane-3,4,5-triol

• 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: 2-[2-[3',16-Dihydroxy-7,9,13-trimethyl-5'-methylidene-4'-(3,4,5-trihydroxyoxan-2-yl)spiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icos-18-ene-6,2'-oxane]-14-yl]oxy-5-hydroxy-6-methyl-3-(3,4,5-trihydroxyoxan-2-yl)oxyoxan-4-yl]oxy-6-methyloxane-3,4,5-triol
• 英文别名: 2-[2-[3',16-dihydroxy-7,9,13-trimethyl-5'-methylidene-4'-(3,4,5-trihydroxyoxan-2-yl)spiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icos-18-ene-6,2'-oxane]-14-yl]oxy-5-hydroxy-6-methyl-3-(3,4,5-trihydroxyoxan-2-yl)oxyoxan-4-yl]oxy-6-methyloxane-3,4,5-triol
• 化学式: C₄₉H₇₆O₂₁
• 分子量: 1001.1
• InChiKey: MZMYTYKGLFWNHG-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  -3
• 重原子数：
  70
• 可旋转键数：
  7
• 环数：
  10.0
• sp3杂化的碳原子比例：
  0.92
• 拓扑面积：
  326
• 氢给体数：
  12
• 氢受体数：
  21