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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 C07268
pubchemid 9477
name Nitrofurantoin
formula C8H6N4O5
structure
Isomeric_Smiles CCOP(=S)(CC)OC1=CC(=C(C=C1Cl)Cl)Cl
Cannoical_Smiles CCOP(=S)(CC)OC1=CC(=C(C=C1Cl)Cl)Cl
Gotenzyme_Smiles O=C1CN(/N=C/c2ccc([N+](=O)[O-])o2)C(=O)N1