1-[3'a-(1,2,4a,5,5a,6,7,8,9,9a,10,10a-dodecahydropyrido[3,4-g]quinolin-10-ylmethyl)-2'-(2-hydroxypropylamino)-4-(methylamino)spiro[3,3a,4,6a-tetrahydro-1H-pentalene-2,1'-3,4,5,6,7,7a-hexahydro-2H-indene]-5'-yl]-6-[2-[[2-amino-4-[2-[3-(2-phenylethyl)phenyl]ethyl]-1,2-dihydropyridin-5-yl]methyl]-4-hydroxy-5-methoxyphenyl]-7-hydroxyhept-5-ene-2,4-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: 1-[3'a-(1,2,4a,5,5a,6,7,8,9,9a,10,10a-dodecahydropyrido[3,4-g]quinolin-10-ylmethyl)-2'-(2-hydroxypropylamino)-4-(methylamino)spiro[3,3a,4,6a-tetrahydro-1H-pentalene-2,1'-3,4,5,6,7,7a-hexahydro-2H-indene]-5'-yl]-6-[2-[[2-amino-4-[2-[3-(2-phenylethyl)phenyl]ethyl]-1,2-dihydropyridin-5-yl]methyl]-4-hydroxy-5-methoxyphenyl]-7-hydroxyhept-5-ene-2,4-dione
• 化学式: C₆₉H₉₂N₆O₆
• 分子量: 1101.5
• InChiKey: AQKSDGUJVDBHCC-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  8.2
• 重原子数：
  81
• 可旋转键数：
  22
• 环数：
  11.0
• sp3杂化的碳原子比例：
  0.57
• 拓扑面积：
  190
• 氢给体数：
  9
• 氢受体数：
  12