3'-[2-[2-Amino-6-[2-(5,6-dihydropyrrolo[3,4-b]pyrrol-5-ium-5-ylmethyl)-6-(pentylamino)pyridin-4-yl]pyridin-4-yl]ethyl]-20-hydroxy-10,10,16-trimethylspiro[8,11,15-trioxatetracyclo[10.8.0.02,9.014,19]icosa-1(12),13,16,19-tetraene-6,2'-oxirane]-7,18-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: 3'-[2-[2-Amino-6-[2-(5,6-dihydropyrrolo[3,4-b]pyrrol-5-ium-5-ylmethyl)-6-(pentylamino)pyridin-4-yl]pyridin-4-yl]ethyl]-20-hydroxy-10,10,16-trimethylspiro[8,11,15-trioxatetracyclo[10.8.0.02,9.014,19]icosa-1(12),13,16,19-tetraene-6,2'-oxirane]-7,18-dione
• 英文别名: 3'-[2-[2-amino-6-[2-(5,6-dihydropyrrolo[3,4-b]pyrrol-5-ium-5-ylmethyl)-6-(pentylamino)pyridin-4-yl]pyridin-4-yl]ethyl]-20-hydroxy-10,10,16-trimethylspiro[8,11,15-trioxatetracyclo[10.8.0.02,9.014,19]icosa-1(12),13,16,19-tetraene-6,2'-oxirane]-7,18-dione
• 化学式: C45H51N6O7+
• 分子量: 787.9
• InChiKey: YWRYQKIFMWBSND-UHFFFAOYSA-O

计算性质

• 辛醇/水分配系数(LogP)：
  6.5
• 重原子数：
  58
• 可旋转键数：
  11
• 环数：
  9.0
• sp3杂化的碳原子比例：
  0.44
• 拓扑面积：
  175
• 氢给体数：
  4
• 氢受体数：
  12