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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 C14470
pubchemid 17395470
name 3-Methylcholanthrene
formula C21H16
structure
Isomeric_Smiles CC1=C(C(=NN1CC2=CC=CC=C2)C)CNC(=O)C3=CNC(=O)C=C3
Cannoical_Smiles CC1=C(C(=NN1CC2=CC=CC=C2)C)CNC(=O)C3=CNC(=O)C=C3
Gotenzyme_Smiles Cc1ccc2cc3c(ccc4ccccc43)c3c2c1CC3