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MTC 智能计算中心MTC Computing Center AI × 蛋白质与酶工程AI for Protein & Enzyme Engineering

化合物信息

名称 内容
kegg编号 C18678
pubchemid 124489352
name UWM6
formula C19H18O6
structure
Isomeric_Smiles CNC[C@H]1CCN(C1)S(=O)(=O)C2=CC(=CC(=C2)Cl)Cl
Cannoical_Smiles CNCC1CCN(C1)S(=O)(=O)C2=CC(=CC(=C2)Cl)Cl
Gotenzyme_Smiles C[C@]1(O)CC(=O)C2c3cc4cccc(O)c4c(O)c3C(=O)C[C@]2(O)C1