[(1R,4S,4aR,6S)-4-[2-[[(1S,4R,7S,8aR)-4-[(Z)-2,4-dimethyloct-2-enoyl]oxy-7-(1-formylvinyl)-8a-methyl-6-oxo-1,2,3,4,7,8-hexahydronaphthalene-1-carbonyl]amino]ethylcarbamoyl]-6-(1-formylvinyl)-4a-methyl-7-oxo-1,2,3,4,5,6-hexahydronaphthalen-1-yl] (Z)-2,4-dimethyloct-2-enoate

• 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: [(1R,4S,4aR,6S)-4-[2-[[(1S,4R,7S,8aR)-4-[(Z)-2,4-dimethyloct-2-enoyl]oxy-7-(1-formylvinyl)-8a-methyl-6-oxo-1,2,3,4,7,8-hexahydronaphthalene-1-carbonyl]amino]ethylcarbamoyl]-6-(1-formylvinyl)-4a-methyl-7-oxo-1,2,3,4,5,6-hexahydronaphthalen-1-yl] (Z)-2,4-dimethyloct-2-enoate
• 英文别名: [(1R,4S,4aR,6S)-4-[2-[[(1S,4R,7S,8aR)-4-[(Z)-2,4-dimethyloct-2-enoyl]oxy-8a-methyl-6-oxo-7-(3-oxoprop-1-en-2-yl)-1,2,3,4,7,8-hexahydronaphthalene-1-carbonyl]amino]ethylcarbamoyl]-4a-methyl-7-oxo-6-(3-oxoprop-1-en-2-yl)-1,2,3,4,5,6-hexahydronaphthalen-1-yl] (Z)-2,4-dimethyloct-2-enoate
• 化学式: C₅₂H₇₂N₂O₁₀
• 分子量: 885.1
• InChiKey: GCAGMRISHGRVDH-LYYKVUDLSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  7.7
• 重原子数：
  64
• 可旋转键数：
  23
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.62
• 拓扑面积：
  179
• 氢给体数：
  2
• 氢受体数：
  10