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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 C18547
pubchemid 124489221
name Boscalid
formula C18H12Cl2N2O
structure
Isomeric_Smiles C1=CC(=C(C=C1Cl)Cl)[C@H](C(F)(F)F)Br
Cannoical_Smiles C1=CC(=C(C=C1Cl)Cl)C(C(F)(F)F)Br
Gotenzyme_Smiles O=C(Nc1ccccc1-c1ccc(Cl)cc1)c1cccnc1Cl