8-(1,2,4a,5,5a,6,7,8,9,9a,10,10a-Dodecahydropyrido[3,4-g]quinolin-10-ylmethyl)-29,41-diamino-22-hydroxy-18-(hydroxymethyl)-6-(2-hydroxypropylamino)-21-methoxy-47-[2-[3-(2-phenylethyl)phenyl]ethyl]-44,45-dithia-28,40,42-triazaoctacyclo[29.7.7.12,5.18,12.126,30.133,37.05,9.019,24]nonatetraconta-17,19,21,23,26,30(47),33,35,37(46),41-decaene-14,16-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: 8-(1,2,4a,5,5a,6,7,8,9,9a,10,10a-Dodecahydropyrido[3,4-g]quinolin-10-ylmethyl)-29,41-diamino-22-hydroxy-18-(hydroxymethyl)-6-(2-hydroxypropylamino)-21-methoxy-47-[2-[3-(2-phenylethyl)phenyl]ethyl]-44,45-dithia-28,40,42-triazaoctacyclo[29.7.7.12,5.18,12.126,30.133,37.05,9.019,24]nonatetraconta-17,19,21,23,26,30(47),33,35,37(46),41-decaene-14,16-dione
• 英文别名: 8-(1,2,4a,5,5a,6,7,8,9,9a,10,10a-dodecahydropyrido[3,4-g]quinolin-10-ylmethyl)-29,41-diamino-22-hydroxy-18-(hydroxymethyl)-6-(2-hydroxypropylamino)-21-methoxy-47-[2-[3-(2-phenylethyl)phenyl]ethyl]-44,45-dithia-28,40,42-triazaoctacyclo[29.7.7.12,5.18,12.126,30.133,37.05,9.019,24]nonatetraconta-17,19,21,23,26,30(47),33,35,37(46),41-decaene-14,16-dione
• 化学式: C₇₈H₁₀₂N₈O₆S₂
• 分子量: 1311.8
• InChiKey: RUEQJSSXYXQBFB-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  9.1
• 重原子数：
  94
• 可旋转键数：
  13
• 环数：
  14.0
• sp3杂化的碳原子比例：
  0.55
• 拓扑面积：
  279
• 氢给体数：
  10
• 氢受体数：
  14