11-(1,2,4a,5,5a,6,7,8,9,9a,10,10a-Dodecahydropyrido[3,4-g]quinolin-10-ylmethyl)-32,40-diamino-6,25-dihydroxy-24-(hydroxymethoxy)-21-(hydroxymethyl)-35-[[3-(2-phenylethyl)phenyl]methyl]spiro[8,31,39,41-tetrazanonacyclo[40.6.1.111,15.02,7.09,47.012,47.022,27.029,34.044,48]pentaconta-1,3,20,22,24,26,29,33,39-nonaen-37-yne-5,1'-cyclopentane]-17,19-dione

• 分子结构分类: 有机化合物 - 脂质和类脂质分子 - 异戊烯醇脂质
• 英文名称: 11-(1,2,4a,5,5a,6,7,8,9,9a,10,10a-Dodecahydropyrido[3,4-g]quinolin-10-ylmethyl)-32,40-diamino-6,25-dihydroxy-24-(hydroxymethoxy)-21-(hydroxymethyl)-35-[[3-(2-phenylethyl)phenyl]methyl]spiro[8,31,39,41-tetrazanonacyclo[40.6.1.111,15.02,7.09,47.012,47.022,27.029,34.044,48]pentaconta-1,3,20,22,24,26,29,33,39-nonaen-37-yne-5,1'-cyclopentane]-17,19-dione
• 英文别名: 11-(1,2,4a,5,5a,6,7,8,9,9a,10,10a-dodecahydropyrido[3,4-g]quinolin-10-ylmethyl)-32,40-diamino-6,25-dihydroxy-24-(hydroxymethoxy)-21-(hydroxymethyl)-35-[[3-(2-phenylethyl)phenyl]methyl]spiro[8,31,39,41-tetrazanonacyclo[40.6.1.111,15.02,7.09,47.012,47.022,27.029,34.044,48]pentaconta-1,3,20,22,24,26,29,33,39-nonaen-37-yne-5,1'-cyclopentane]-17,19-dione
• 化学式: C₈₀H₁₀₀N₈O₇
• 分子量: 1285.7
• InChiKey: QHANKWAVVLGIQN-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  8.4
• 重原子数：
  95
• 可旋转键数：
  10
• 环数：
  18.0
• sp3杂化的碳原子比例：
  0.56
• 拓扑面积：
  249
• 氢给体数：
  11
• 氢受体数：
  13