3'-[2-[2-Amino-6-[2-amino-6-(5,6-dihydropyrrolo[3,4-b]pyrrol-5-ium-5-ylmethyl)pyridin-4-yl]pyridin-4-yl]ethyl]-12-hydroxy-2,2,8-trimethylspiro[3,7,20-trioxapentacyclo[14.4.2.01,14.04,13.06,11]docosa-4(13),5,8,11-tetraene-18,2'-oxirane]-10,19-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-amino-6-(5,6-dihydropyrrolo[3,4-b]pyrrol-5-ium-5-ylmethyl)pyridin-4-yl]pyridin-4-yl]ethyl]-12-hydroxy-2,2,8-trimethylspiro[3,7,20-trioxapentacyclo[14.4.2.01,14.04,13.06,11]docosa-4(13),5,8,11-tetraene-18,2'-oxirane]-10,19-dione
• 英文别名: 3'-[2-[2-amino-6-[2-amino-6-(5,6-dihydropyrrolo[3,4-b]pyrrol-5-ium-5-ylmethyl)pyridin-4-yl]pyridin-4-yl]ethyl]-12-hydroxy-2,2,8-trimethylspiro[3,7,20-trioxapentacyclo[14.4.2.01,14.04,13.06,11]docosa-4(13),5,8,11-tetraene-18,2'-oxirane]-10,19-dione
• 化学式: C42H43N6O7+
• 分子量: 743.8
• InChiKey: MKNLLZKNDPWOOL-UHFFFAOYSA-O

计算性质

• 辛醇/水分配系数(LogP)：
  4.3
• 重原子数：
  55
• 可旋转键数：
  6
• 环数：
  11.0
• sp3杂化的碳原子比例：
  0.4
• 拓扑面积：
  189
• 氢给体数：
  4
• 氢受体数：
  12