[4-[3-(6-Amino-1,2-dihydropyridin-4-yl)propylimino]-6'-[3,4-dihydroxy-5-(2-pyridin-3-ylethoxy)phenyl]-23'-hydroxyspiro[1,3,5,14-tetrazatetracyclo[8.6.0.02,7.011,15]hexadeca-10,12,15-triene-6,16'-5,21-dioxapentacyclo[20.3.1.03,12.04,9.015,20]hexacosa-1(26),22,24-trien-13-yne]-8'-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: [4-[3-(6-Amino-1,2-dihydropyridin-4-yl)propylimino]-6'-[3,4-dihydroxy-5-(2-pyridin-3-ylethoxy)phenyl]-23'-hydroxyspiro[1,3,5,14-tetrazatetracyclo[8.6.0.02,7.011,15]hexadeca-10,12,15-triene-6,16'-5,21-dioxapentacyclo[20.3.1.03,12.04,9.015,20]hexacosa-1(26),22,24-trien-13-yne]-8'-yl] acetate
• 英文别名: [4-[3-(6-amino-1,2-dihydropyridin-4-yl)propylimino]-6'-[3,4-dihydroxy-5-(2-pyridin-3-ylethoxy)phenyl]-23'-hydroxyspiro[1,3,5,14-tetrazatetracyclo[8.6.0.02,7.011,15]hexadeca-10,12,15-triene-6,16'-5,21-dioxapentacyclo[20.3.1.03,12.04,9.015,20]hexacosa-1(26),22,24-trien-13-yne]-8'-yl] acetate
• 化学式: C₅₈H₆₆N₈O₈
• 分子量: 1003.2
• InChiKey: VMHYHVMPRWDFSC-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  6.8
• 重原子数：
  74
• 可旋转键数：
  11
• 环数：
  12.0
• sp3杂化的碳原子比例：
  0.47
• 拓扑面积：
  223
• 氢给体数：
  8
• 氢受体数：
  12