14-Cyclohexyl-45,59-dihydroxy-13-(hydroxymethylidene)-44-methyl-41-(2-methylpropyl)-3'-(2-phenylethyl)spiro[18,20-diazatetradecacyclo[38.16.2.219,22.19,56.123,27.140,44.01,52.02,6.09,52.029,38.030,35.037,48.049,57.048,60]trihexaconta-7,19(63),22(62),23,25,27(61),29,31,33,35,38,41,49(57)-tridecaene-5,1'-cyclopentane]-10-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: 14-Cyclohexyl-45,59-dihydroxy-13-(hydroxymethylidene)-44-methyl-41-(2-methylpropyl)-3'-(2-phenylethyl)spiro[18,20-diazatetradecacyclo[38.16.2.219,22.19,56.123,27.140,44.01,52.02,6.09,52.029,38.030,35.037,48.049,57.048,60]trihexaconta-7,19(63),22(62),23,25,27(61),29,31,33,35,38,41,49(57)-tridecaene-5,1'-cyclopentane]-10-carboxylic acid
• 英文别名: 14-cyclohexyl-45,59-dihydroxy-13-(hydroxymethylidene)-44-methyl-41-(2-methylpropyl)-3'-(2-phenylethyl)spiro[18,20-diazatetradecacyclo[38.16.2.219,22.19,56.123,27.140,44.01,52.02,6.09,52.029,38.030,35.037,48.049,57.048,60]trihexaconta-7,19(63),22(62),23,25,27(61),29,31,33,35,38,41,49(57)-tridecaene-5,1'-cyclopentane]-10-carboxylic acid
• 化学式: C₈₆H₁₀₆N₂O₅
• 分子量: 1247.8
• InChiKey: AMDGYGWDRNIISZ-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  17.8
• 重原子数：
  93
• 可旋转键数：
  7
• 环数：
  19.0
• sp3杂化的碳原子比例：
  0.59
• 拓扑面积：
  122
• 氢给体数：
  6
• 氢受体数：
  7