3-[29-(Diaminomethylideneamino)-2,12,35-trihydroxy-1,15,15,19,33-pentamethyl-16,21-dioxo-13-(2-phenylethenyl)-35-decacyclo[18.13.1.15,28.02,10.03,32.04,8.012,34.014,19.022,33.027,32]pentatriaconta-4(8),5,10,20(34),30-pentaenyl]-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-[29-(Diaminomethylideneamino)-2,12,35-trihydroxy-1,15,15,19,33-pentamethyl-16,21-dioxo-13-(2-phenylethenyl)-35-decacyclo[18.13.1.15,28.02,10.03,32.04,8.012,34.014,19.022,33.027,32]pentatriaconta-4(8),5,10,20(34),30-pentaenyl]-3-hydroxy-2-methylprop-2-enoic acid
• 英文别名: 3-[29-(diaminomethylideneamino)-2,12,35-trihydroxy-1,15,15,19,33-pentamethyl-16,21-dioxo-13-(2-phenylethenyl)-35-decacyclo[18.13.1.15,28.02,10.03,32.04,8.012,34.014,19.022,33.027,32]pentatriaconta-4(8),5,10,20(34),30-pentaenyl]-3-hydroxy-2-methylprop-2-enoic acid
• 化学式: C₅₃H₆₁N₃O₈
• 分子量: 868.1
• InChiKey: SNCAPFPJRYUDCG-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.6
• 重原子数：
  64
• 可旋转键数：
  5
• 环数：
  11.0
• sp3杂化的碳原子比例：
  0.55
• 拓扑面积：
  217
• 氢给体数：
  7
• 氢受体数：
  9