[2-[4-[3-(6-Amino-1,2-dihydropyridin-4-yl)propylimino]-17'-hydroxyspiro[1,3,5,14-tetrazatetracyclo[8.6.0.02,7.011,15]hexadeca-10,12,15-triene-6,7'-2-oxatricyclo[12.3.1.03,8]octadeca-1(17),14(18),15-trien-9-yne]-12'-yl]-6-[3,4-dihydroxy-5-(2-pyridin-3-ylethoxy)phenyl]oxan-4-yl] acetate

• 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: [2-[4-[3-(6-Amino-1,2-dihydropyridin-4-yl)propylimino]-17'-hydroxyspiro[1,3,5,14-tetrazatetracyclo[8.6.0.02,7.011,15]hexadeca-10,12,15-triene-6,7'-2-oxatricyclo[12.3.1.03,8]octadeca-1(17),14(18),15-trien-9-yne]-12'-yl]-6-[3,4-dihydroxy-5-(2-pyridin-3-ylethoxy)phenyl]oxan-4-yl] acetate
• 英文别名: [2-[4-[3-(6-amino-1,2-dihydropyridin-4-yl)propylimino]-17'-hydroxyspiro[1,3,5,14-tetrazatetracyclo[8.6.0.02,7.011,15]hexadeca-10,12,15-triene-6,7'-2-oxatricyclo[12.3.1.03,8]octadeca-1(17),14(18),15-trien-9-yne]-12'-yl]-6-[3,4-dihydroxy-5-(2-pyridin-3-ylethoxy)phenyl]oxan-4-yl] acetate
• 化学式: C₅₆H₆₄N₈O₈
• 分子量: 977.2
• InChiKey: VYVNAXIFWDFBRK-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  6.4
• 重原子数：
  72
• 可旋转键数：
  12
• 环数：
  11.0
• sp3杂化的碳原子比例：
  0.45
• 拓扑面积：
  223
• 氢给体数：
  8
• 氢受体数：
  12