26-Cyclohexyl-20,46-dihydroxy-68-methyl-25-methylidene-30,32-diazapentadecacyclo[43.15.3.231,34.11,45.16,18.135,39.03,18.04,49.08,17.010,15.040,58.050,59.052,57.021,68.049,64]octahexaconta-3,9,11,13,15,31(67),34(66),35,37,39(65),51,53,55,57,59,61-hexadecaen-42-yne-22-carboxylic 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: 26-Cyclohexyl-20,46-dihydroxy-68-methyl-25-methylidene-30,32-diazapentadecacyclo[43.15.3.231,34.11,45.16,18.135,39.03,18.04,49.08,17.010,15.040,58.050,59.052,57.021,68.049,64]octahexaconta-3,9,11,13,15,31(67),34(66),35,37,39(65),51,53,55,57,59,61-hexadecaen-42-yne-22-carboxylic acid
• 英文别名: 26-cyclohexyl-20,46-dihydroxy-68-methyl-25-methylidene-30,32-diazapentadecacyclo[43.15.3.231,34.11,45.16,18.135,39.03,18.04,49.08,17.010,15.040,58.050,59.052,57.021,68.049,64]octahexaconta-3,9,11,13,15,31(67),34(66),35,37,39(65),51,53,55,57,59,61-hexadecaen-42-yne-22-carboxylic acid
• 化学式: C₇₅H₈₂N₂O₄
• 分子量: 1075.5
• InChiKey: AKIJVDPQNCOMCW-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  12.9
• 重原子数：
  81
• 可旋转键数：
  2
• 环数：
  19.0
• sp3杂化的碳原子比例：
  0.51
• 拓扑面积：
  102
• 氢给体数：
  5
• 氢受体数：
  6