2,15,39-Trihydroxy-14-methoxy-43-methyl-18-phenyl-3-propyl-45,46-dithia-28,30,41,53-tetrazadecacyclo[41.8.4.331,37.11,48.14,23.125,29.152,55.06,21.012,17.034,59]dohexaconta-12,14,16,25,29(61),31(60),32,34(59),35,37(58),52(56),54-dodecaen-19-yne-7,9-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: 2,15,39-Trihydroxy-14-methoxy-43-methyl-18-phenyl-3-propyl-45,46-dithia-28,30,41,53-tetrazadecacyclo[41.8.4.331,37.11,48.14,23.125,29.152,55.06,21.012,17.034,59]dohexaconta-12,14,16,25,29(61),31(60),32,34(59),35,37(58),52(56),54-dodecaen-19-yne-7,9-dione
• 英文别名: 2,15,39-trihydroxy-14-methoxy-43-methyl-18-phenyl-3-propyl-45,46-dithia-28,30,41,53-tetrazadecacyclo[41.8.4.331,37.11,48.14,23.125,29.152,55.06,21.012,17.034,59]dohexaconta-12,14,16,25,29(61),31(60),32,34(59),35,37(58),52(56),54-dodecaen-19-yne-7,9-dione
• 化学式: C₆₇H₈₀N₄O₆S₂
• 分子量: 1101.5
• InChiKey: ZCYGYNTZCFSSDV-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  12.2
• 重原子数：
  79
• 可旋转键数：
  4
• 环数：
  11.0
• sp3杂化的碳原子比例：
  0.49
• 拓扑面积：
  207
• 氢给体数：
  7
• 氢受体数：
  11