Methyl 11-[3-[4,5-dihydroxy-3-[3-hydroxy-5-[3-hydroxy-5-[3-(3-hydroxy-2-methylbutanoyl)oxy-2-methylbutanoyl]oxy-6-methyl-4-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxyoxan-2-yl]oxy-6-methyl-4-(2-methylbutanoyloxy)oxan-2-yl]oxy-6-(hydroxymethyl)oxan-2-yl]oxy-4,5-dihydroxy-6-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxymethyl]oxan-2-yl]oxy-3-hydroxyhexadecanoate

• 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: Methyl 11-[3-[4,5-dihydroxy-3-[3-hydroxy-5-[3-hydroxy-5-[3-(3-hydroxy-2-methylbutanoyl)oxy-2-methylbutanoyl]oxy-6-methyl-4-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxyoxan-2-yl]oxy-6-methyl-4-(2-methylbutanoyloxy)oxan-2-yl]oxy-6-(hydroxymethyl)oxan-2-yl]oxy-4,5-dihydroxy-6-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxymethyl]oxan-2-yl]oxy-3-hydroxyhexadecanoate
• 英文别名: methyl 11-[3-[4,5-dihydroxy-3-[3-hydroxy-5-[3-hydroxy-5-[3-(3-hydroxy-2-methylbutanoyl)oxy-2-methylbutanoyl]oxy-6-methyl-4-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxyoxan-2-yl]oxy-6-methyl-4-(2-methylbutanoyloxy)oxan-2-yl]oxy-6-(hydroxymethyl)oxan-2-yl]oxy-4,5-dihydroxy-6-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxymethyl]oxan-2-yl]oxy-3-hydroxyhexadecanoate
• 化学式: C₆₈H₁₁₈O₃₅
• 分子量: 1495.6
• InChiKey: ZRIHLJHSVPVTKM-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  -0.3
• 重原子数：
  103
• 可旋转键数：
  41
• 环数：
  6.0
• sp3杂化的碳原子比例：
  0.94
• 拓扑面积：
  519
• 氢给体数：
  15
• 氢受体数：
  35