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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 C18873
pubchemid 124489545
name Nitrothal-isopropyl
formula C14H17NO6
structure
Isomeric_Smiles C[C@@H]1CN(C[C@H](O1)C)S(=O)(=O)N(C)[C@@H]2CCNC2
Cannoical_Smiles CC1CN(CC(O1)C)S(=O)(=O)N(C)C2CCNC2
Gotenzyme_Smiles CC(C)OC(=O)c1cc(C(=O)OC(C)C)cc([N+](=O)[O-])c1