[4-Hydroxy-2-(2-hydroxypropyl)-6-[1,4,8-trihydroxy-13-[3-[14-[5-[4-[3-hydroxy-5-(2-methylidenepent-4-enyl)oxolan-2-yl]but-2-enyl]-3,6-dihydro-1,2-dioxin-3-yl]-3-methyltetradec-11-enyl]oxiran-2-yl]-6-oxo-10-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxytridecyl]oxan-3-yl] hydrogen sulfate

• 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: [4-Hydroxy-2-(2-hydroxypropyl)-6-[1,4,8-trihydroxy-13-[3-[14-[5-[4-[3-hydroxy-5-(2-methylidenepent-4-enyl)oxolan-2-yl]but-2-enyl]-3,6-dihydro-1,2-dioxin-3-yl]-3-methyltetradec-11-enyl]oxiran-2-yl]-6-oxo-10-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxytridecyl]oxan-3-yl] hydrogen sulfate
• 英文别名: [4-hydroxy-2-(2-hydroxypropyl)-6-[1,4,8-trihydroxy-13-[3-[14-[5-[4-[3-hydroxy-5-(2-methylidenepent-4-enyl)oxolan-2-yl]but-2-enyl]-3,6-dihydro-1,2-dioxin-3-yl]-3-methyltetradec-11-enyl]oxiran-2-yl]-6-oxo-10-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxytridecyl]oxan-3-yl] hydrogen sulfate
• 化学式: C₆₂H₁₀₄O₂₂S
• 分子量: 1233.5
• InChiKey: XTPMKVVOQZNTAQ-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  5.4
• 重原子数：
  85
• 可旋转键数：
  43
• 环数：
  5.0
• sp3杂化的碳原子比例：
  0.82
• 拓扑面积：
  359
• 氢给体数：
  11
• 氢受体数：
  22