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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 C11099
pubchemid 13281
name Fipronil
formula C12H4Cl2F6N4OS
structure
Isomeric_Smiles CCOC(=O)CC(=O)C1=CC=C(C=C1)[N+](=O)[O-]
Cannoical_Smiles CCOC(=O)CC(=O)C1=CC=C(C=C1)[N+](=O)[O-]
Gotenzyme_Smiles N#Cc1nn(-c2c(Cl)cc(C(F)(F)F)cc2Cl)c(N)c1S(=O)C(F)(F)F