[5-Amino-6'-(2,2-dimethylpropanoyloxy)-3-oxospiro[2-benzofuran-1,9'-xanthene]-3'-yl] 2,2-dimethylpropanoate;5-amino-2-(3-hydroxy-6-oxoxanthen-9-yl)benzoic acid;[5-[2-bromoethyl(methyl)amino]-6'-(2,2-dimethylpropanoyloxy)-3-oxospiro[2-benzofuran-1,9'-xanthene]-3'-yl] 2,2-dimethylpropanoate;3,3-dimethylbutan-2-one;[6'-(2,2-dimethylpropanoyloxy)-5-(methylamino)-3-oxospiro[2-benzofuran-1,9'-xanthene]-3'-yl] 2,2-dimethylpropanoate;1-methylsulfonyl-4-nitrobenzene

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 苯并吡喃
• 英文名称: [5-Amino-6'-(2,2-dimethylpropanoyloxy)-3-oxospiro[2-benzofuran-1,9'-xanthene]-3'-yl] 2,2-dimethylpropanoate;5-amino-2-(3-hydroxy-6-oxoxanthen-9-yl)benzoic acid;[5-[2-bromoethyl(methyl)amino]-6'-(2,2-dimethylpropanoyloxy)-3-oxospiro[2-benzofuran-1,9'-xanthene]-3'-yl] 2,2-dimethylpropanoate;3,3-dimethylbutan-2-one;[6'-(2,2-dimethylpropanoyloxy)-5-(methylamino)-3-oxospiro[2-benzofuran-1,9'-xanthene]-3'-yl] 2,2-dimethylpropanoate;1-methylsulfonyl-4-nitrobenzene
• 英文别名: [5-amino-6'-(2,2-dimethylpropanoyloxy)-3-oxospiro[2-benzofuran-1,9'-xanthene]-3'-yl] 2,2-dimethylpropanoate;5-amino-2-(3-hydroxy-6-oxoxanthen-9-yl)benzoic acid;[5-[2-bromoethyl(methyl)amino]-6'-(2,2-dimethylpropanoyloxy)-3-oxospiro[2-benzofuran-1,9'-xanthene]-3'-yl] 2,2-dimethylpropanoate;3,3-dimethylbutan-2-one;[6'-(2,2-dimethylpropanoyloxy)-5-(methylamino)-3-oxospiro[2-benzofuran-1,9'-xanthene]-3'-yl] 2,2-dimethylpropanoate;1-methylsulfonyl-4-nitrobenzene
• 化学式: C127H126BrN5O31S
• 分子量: 2330.3
• InChiKey: CLBWZABUELVISS-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  25.1
• 重原子数：
  165
• 可旋转键数：
  26
• 环数：
  20.0
• sp3杂化的碳原子比例：
  0.29
• 拓扑面积：
  521
• 氢给体数：
  5
• 氢受体数：
  35