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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 C18938
pubchemid 124489610
name Fenitropan
formula C13H15NO6
structure
Isomeric_Smiles C[C@H](C(=O)N1CCCC1)SC2=NN=C(N2C)CN
Cannoical_Smiles CC(C(=O)N1CCCC1)SC2=NN=C(N2C)CN
Gotenzyme_Smiles CC(=O)OC[C@H]([C@@H](OC(C)=O)c1ccccc1)[N+](=O)[O-]