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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 C19027
pubchemid 124489699
name Chloropropylate
formula C17H16Cl2O3
structure
Isomeric_Smiles C[C@@H]1CCNC[C@@H]1NS(=O)(=O)C2=C(C=C(C=C2)C)C
Cannoical_Smiles CC1CCNCC1NS(=O)(=O)C2=C(C=C(C=C2)C)C
Gotenzyme_Smiles CC(C)OC(=O)C(O)(c1ccc(Cl)cc1)c1ccc(Cl)cc1