2-[[6-[5-Acetamido-6-[2-[6-[3-[4-(dithiolan-3-yl)butoxymethylamino]anilino]-1,2,4,5-tetrahydroxyhexan-3-yl]oxy-3,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl]oxy-4-hydroxy-2-(hydroxymethyl)oxan-3-yl]oxy-3,4,5-trihydroxyoxan-2-yl]methoxy]-5-acetyl-4-hydroxy-6-(1,2,3-trihydroxypropyl)oxane-2-carboxylic acid

• 分子结构分类: 有机化合物 - 有机氧化合物
• 英文名称: 2-[[6-[5-Acetamido-6-[2-[6-[3-[4-(dithiolan-3-yl)butoxymethylamino]anilino]-1,2,4,5-tetrahydroxyhexan-3-yl]oxy-3,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl]oxy-4-hydroxy-2-(hydroxymethyl)oxan-3-yl]oxy-3,4,5-trihydroxyoxan-2-yl]methoxy]-5-acetyl-4-hydroxy-6-(1,2,3-trihydroxypropyl)oxane-2-carboxylic acid
• 英文别名: 2-[[6-[5-acetamido-6-[2-[6-[3-[4-(dithiolan-3-yl)butoxymethylamino]anilino]-1,2,4,5-tetrahydroxyhexan-3-yl]oxy-3,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl]oxy-4-hydroxy-2-(hydroxymethyl)oxan-3-yl]oxy-3,4,5-trihydroxyoxan-2-yl]methoxy]-5-acetyl-4-hydroxy-6-(1,2,3-trihydroxypropyl)oxane-2-carboxylic acid
• 化学式: C₅₁H₈₃N₃O₂₉S₂
• 分子量: 1266.3
• InChiKey: FYXZJIAPFVQXBX-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  -6.9
• 重原子数：
  85
• 可旋转键数：
  32
• 环数：
  6.0
• sp3杂化的碳原子比例：
  0.82
• 拓扑面积：
  565
• 氢给体数：
  20
• 氢受体数：
  33

文献信息

• US8765384B2
  申请人：——

  公开号：US8765384B2

  公开（公告）日：2014-07-01