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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 C12755
pubchemid 583144
name Mequitazine
formula C20H22N2S
structure
Isomeric_Smiles CC(=CCC(=O)O)C1=CC=CC=C1
Cannoical_Smiles CC(=CCC(=O)O)C1=CC=CC=C1
Gotenzyme_Smiles c1ccc2c(c1)Sc1ccccc1N2CC1CN2CCC1CC2