3-[6-[(Diaminomethylideneamino)methyl]-2,7,15-trihydroxy-1,5,18,18,22,26-hexamethyl-19,24-dioxo-16-(2-phenylethenyl)-7-octacyclo[13.11.1.13,8.02,13.04,26.017,22.023,27.011,28]octacosa-8,11(28),13,23(27)-tetraenyl]-3-hydroxy-2-methylprop-2-enoic acid

• 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-[6-[(Diaminomethylideneamino)methyl]-2,7,15-trihydroxy-1,5,18,18,22,26-hexamethyl-19,24-dioxo-16-(2-phenylethenyl)-7-octacyclo[13.11.1.13,8.02,13.04,26.017,22.023,27.011,28]octacosa-8,11(28),13,23(27)-tetraenyl]-3-hydroxy-2-methylprop-2-enoic acid
• 英文别名: 3-[6-[(diaminomethylideneamino)methyl]-2,7,15-trihydroxy-1,5,18,18,22,26-hexamethyl-19,24-dioxo-16-(2-phenylethenyl)-7-octacyclo[13.11.1.13,8.02,13.04,26.017,22.023,27.011,28]octacosa-8,11(28),13,23(27)-tetraenyl]-3-hydroxy-2-methylprop-2-enoic acid
• 化学式: C₄₈H₅₇N₃O₈
• 分子量: 804.0
• InChiKey: TVRQSJMWPCZTJA-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.9
• 重原子数：
  59
• 可旋转键数：
  6
• 环数：
  9.0
• sp3杂化的碳原子比例：
  0.54
• 拓扑面积：
  217
• 氢给体数：
  7
• 氢受体数：
  9