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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 C14435
pubchemid 17395435
name Benzo[e]pyrene
formula C20H12
structure
Isomeric_Smiles CN(C1CCS(=O)(=O)C1)C(=O)C2=CC(=CC(=C2)F)F
Cannoical_Smiles CN(C1CCS(=O)(=O)C1)C(=O)C2=CC(=CC(=C2)F)F
Gotenzyme_Smiles c1ccc2c(c1)c1cccc3ccc4cccc2c4c31