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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 C14404
pubchemid 17395404
name 2,4-DB
formula C10H10Cl2O3
structure
Isomeric_Smiles CC(C)(C)SCC(=O)N1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)F
Cannoical_Smiles CC(C)(C)SCC(=O)N1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)F
Gotenzyme_Smiles O=C(O)CCCOc1ccc(Cl)cc1Cl