17-[2-(3,3-Dimethyloxiran-2-yl)-2-hydroxyethyl]-24-[(3,5-dimethylphenyl)methyl]-2-hydroxy-6-(3-hydroxypropyl)-4,8,8,12,13,17-hexamethyl-22,26-diazaheptacyclo[14.11.1.120,23.03,12.04,9.013,28.026,29]nonacosa-16(28),20,23(29),24-tetraene-7,15-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: 17-[2-(3,3-Dimethyloxiran-2-yl)-2-hydroxyethyl]-24-[(3,5-dimethylphenyl)methyl]-2-hydroxy-6-(3-hydroxypropyl)-4,8,8,12,13,17-hexamethyl-22,26-diazaheptacyclo[14.11.1.120,23.03,12.04,9.013,28.026,29]nonacosa-16(28),20,23(29),24-tetraene-7,15-dione
• 英文别名: 17-[2-(3,3-dimethyloxiran-2-yl)-2-hydroxyethyl]-24-[(3,5-dimethylphenyl)methyl]-2-hydroxy-6-(3-hydroxypropyl)-4,8,8,12,13,17-hexamethyl-22,26-diazaheptacyclo[14.11.1.120,23.03,12.04,9.013,28.026,29]nonacosa-16(28),20,23(29),24-tetraene-7,15-dione
• 化学式: C₅₁H₇₀N₂O₆
• 分子量: 807.1
• InChiKey: VJKCHTQCYDUUQW-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  7.6
• 重原子数：
  59
• 可旋转键数：
  8
• 环数：
  9.0
• sp3杂化的碳原子比例：
  0.69
• 拓扑面积：
  128
• 氢给体数：
  4
• 氢受体数：
  6