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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 C06977
pubchemid 9191
name Enalapril
formula C20H28N2O5
structure
Isomeric_Smiles C1=CC=C2C(=C1)C=CC3=C2N=CC=C3
Cannoical_Smiles C1=CC=C2C(=C1)C=CC3=C2N=CC=C3
Gotenzyme_Smiles CCOC(=O)[C@H](CCc1ccccc1)N[C@@H](C)C(=O)N1CCC[C@H]1C(=O)O