17-[5-[12-[[3,4-Dihydroxy-5-[1,6,13,16-tetrahydroxy-16-[4-hydroxy-5-methyl-5-(1,6,8-trihydroxy-3,4-dimethylidenenonyl)oxolan-2-yl]-3,9,11-trimethyl-7-oxohexadec-14-enyl]oxolan-2-yl]methyl]-4,9-dihydroxy-10-methylidenetrideca-7,12-dien-2-yl]-2,5-dihydrofuran-2-yl]-9,11,15-trihydroxy-5,10,13,16-tetramethyl-3,7-dimethylideneheptadec-12-enoic acid

• 分子结构分类: 有机化合物 - 脂质和类脂质分子 - 脂肪酰基
• 英文名称: 17-[5-[12-[[3,4-Dihydroxy-5-[1,6,13,16-tetrahydroxy-16-[4-hydroxy-5-methyl-5-(1,6,8-trihydroxy-3,4-dimethylidenenonyl)oxolan-2-yl]-3,9,11-trimethyl-7-oxohexadec-14-enyl]oxolan-2-yl]methyl]-4,9-dihydroxy-10-methylidenetrideca-7,12-dien-2-yl]-2,5-dihydrofuran-2-yl]-9,11,15-trihydroxy-5,10,13,16-tetramethyl-3,7-dimethylideneheptadec-12-enoic acid
• 英文别名: 17-[5-[12-[[3,4-dihydroxy-5-[1,6,13,16-tetrahydroxy-16-[4-hydroxy-5-methyl-5-(1,6,8-trihydroxy-3,4-dimethylidenenonyl)oxolan-2-yl]-3,9,11-trimethyl-7-oxohexadec-14-enyl]oxolan-2-yl]methyl]-4,9-dihydroxy-10-methylidenetrideca-7,12-dien-2-yl]-2,5-dihydrofuran-2-yl]-9,11,15-trihydroxy-5,10,13,16-tetramethyl-3,7-dimethylideneheptadec-12-enoic acid
• 化学式: C₈₁H₁₃₄O₂₁
• 分子量: 1443.9
• InChiKey: HZJGCMGEALNKCX-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  11.4
• 重原子数：
  102
• 可旋转键数：
  52
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.73
• 拓扑面积：
  386
• 氢给体数：
  16
• 氢受体数：
  21