2-(2-Acetamido-4,6-dihydroxyphenyl)-4-(2,4-dihydroxy-6-methylphenyl)cyclobutane-1,3-diolate;2,4-bis(2,4-dihydroxy-3-methylphenyl)cyclobutane-1,3-diolate;2,4-bis(2,4-dihydroxy-5-methylphenyl)cyclobutane-1,3-diolate;2,4-bis(4-hydroxy-2,5-dimethylphenyl)cyclobutane-1,3-diolate;2-[2,4-dihydroxy-6-(hydroxymethylamino)phenyl]-4-(2-formamido-4,6-dihydroxyphenyl)cyclobutane-1,3-diolate

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 英文名称: 2-(2-Acetamido-4,6-dihydroxyphenyl)-4-(2,4-dihydroxy-6-methylphenyl)cyclobutane-1,3-diolate;2,4-bis(2,4-dihydroxy-3-methylphenyl)cyclobutane-1,3-diolate;2,4-bis(2,4-dihydroxy-5-methylphenyl)cyclobutane-1,3-diolate;2,4-bis(4-hydroxy-2,5-dimethylphenyl)cyclobutane-1,3-diolate;2-[2,4-dihydroxy-6-(hydroxymethylamino)phenyl]-4-(2-formamido-4,6-dihydroxyphenyl)cyclobutane-1,3-diolate
• 英文别名: 2-(2-acetamido-4,6-dihydroxyphenyl)-4-(2,4-dihydroxy-6-methylphenyl)cyclobutane-1,3-diolate;2,4-bis(2,4-dihydroxy-3-methylphenyl)cyclobutane-1,3-diolate;2,4-bis(2,4-dihydroxy-5-methylphenyl)cyclobutane-1,3-diolate;2,4-bis(4-hydroxy-2,5-dimethylphenyl)cyclobutane-1,3-diolate;2-[2,4-dihydroxy-6-(hydroxymethylamino)phenyl]-4-(2-formamido-4,6-dihydroxyphenyl)cyclobutane-1,3-diolate
• 化学式: C93H95N3O31-10
• 分子量: 1750.7
• InChiKey: PLVAIKJHQKPTJU-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.49
• 重原子数：
  127
• 可旋转键数：
  14
• 环数：
  15.0
• sp3杂化的碳原子比例：
  0.33
• 拓扑面积：
  685
• 氢给体数：
  22
• 氢受体数：
  32