19-(1,2,4a,5,5a,6,7,8,9,9a,10,10a-Dodecahydropyrido[3,4-g]quinolin-10-ylmethyl)-29,36-diamino-5-hydroxy-9-(hydroxymethyl)-21-(2-hydroxypropylamino)-6-methoxy-24-(methylaminomethyl)-39-[2-[3-(2-phenylethyl)phenyl]ethyl]-32,33-dithia-28,30,37-triazahexacyclo[33.3.1.115,19.122,25.03,8.018,22]hentetraconta-1(38),3,5,7,9,29,35(39)-heptaene-11,13-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: 19-(1,2,4a,5,5a,6,7,8,9,9a,10,10a-Dodecahydropyrido[3,4-g]quinolin-10-ylmethyl)-29,36-diamino-5-hydroxy-9-(hydroxymethyl)-21-(2-hydroxypropylamino)-6-methoxy-24-(methylaminomethyl)-39-[2-[3-(2-phenylethyl)phenyl]ethyl]-32,33-dithia-28,30,37-triazahexacyclo[33.3.1.115,19.122,25.03,8.018,22]hentetraconta-1(38),3,5,7,9,29,35(39)-heptaene-11,13-dione
• 英文别名: 19-(1,2,4a,5,5a,6,7,8,9,9a,10,10a-dodecahydropyrido[3,4-g]quinolin-10-ylmethyl)-29,36-diamino-5-hydroxy-9-(hydroxymethyl)-21-(2-hydroxypropylamino)-6-methoxy-24-(methylaminomethyl)-39-[2-[3-(2-phenylethyl)phenyl]ethyl]-32,33-dithia-28,30,37-triazahexacyclo[33.3.1.115,19.122,25.03,8.018,22]hentetraconta-1(38),3,5,7,9,29,35(39)-heptaene-11,13-dione
• 化学式: C₇₂H₁₀₁N₉O₆S₂
• 分子量: 1252.8
• InChiKey: RHXWRWFAFJXIDJ-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  6.4
• 重原子数：
  89
• 可旋转键数：
  15
• 环数：
  12.0
• sp3杂化的碳原子比例：
  0.6
• 拓扑面积：
  291
• 氢给体数：
  11
• 氢受体数：
  15