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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 C14591
pubchemid 17395591
name Pyridarone
formula C13H9NO
structure
Isomeric_Smiles C1CN(CCN1C2=CC=CC=N2)C(=O)CSC3=NC=CN3C4=CC=C(C=C4)Br
Cannoical_Smiles C1CN(CCN1C2=CC=CC=N2)C(=O)CSC3=NC=CN3C4=CC=C(C=C4)Br
Gotenzyme_Smiles c1ccc2oc(-c3ccncc3)cc2c1