36-(1,2-Dihydroxyethyl)-4,42-dihydroxy-25-(1-hydroxyethyl)-43-(hydroxymethyl)-27-(4-methoxybutanoyl)-2,13,13-trimethylundecacyclo[18.12.8.236,40.14,11.01,19.02,16.07,11.020,35.021,30.023,28.015,43]tritetraconta-5,16,22,24,26,28,38-heptaen-18-one

• 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: 36-(1,2-Dihydroxyethyl)-4,42-dihydroxy-25-(1-hydroxyethyl)-43-(hydroxymethyl)-27-(4-methoxybutanoyl)-2,13,13-trimethylundecacyclo[18.12.8.236,40.14,11.01,19.02,16.07,11.020,35.021,30.023,28.015,43]tritetraconta-5,16,22,24,26,28,38-heptaen-18-one
• 英文别名: 36-(1,2-dihydroxyethyl)-4,42-dihydroxy-25-(1-hydroxyethyl)-43-(hydroxymethyl)-27-(4-methoxybutanoyl)-2,13,13-trimethylundecacyclo[18.12.8.236,40.14,11.01,19.02,16.07,11.020,35.021,30.023,28.015,43]tritetraconta-5,16,22,24,26,28,38-heptaen-18-one
• 化学式: C₅₆H₇₄O₉
• 分子量: 891.2
• InChiKey: MBCGOYSELAXBQM-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  6.4
• 重原子数：
  65
• 可旋转键数：
  9
• 环数：
  12.0
• sp3杂化的碳原子比例：
  0.71
• 拓扑面积：
  165
• 氢给体数：
  6
• 氢受体数：
  9