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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 C18467
pubchemid 124489141
name Hexythiazox
formula C17H21ClN2O2S
structure
Isomeric_Smiles COC(=O)[C@@]1(CCOC1)N2CCNCC2
Cannoical_Smiles COC(=O)C1(CCOC1)N2CCNCC2
Gotenzyme_Smiles C[C@H]1[C@H](c2ccc(Cl)cc2)SC(=O)N1C(=O)NC1CCCCC1