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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 C15659
pubchemid 17396648
name TMC 126
formula C28H38N2O8S
structure
Isomeric_Smiles CC1(C(=O)N(C(=O)N1)CC(C2=CC=CC=C2)O)C3=C(C=CC(=C3)F)F
Cannoical_Smiles CC1(C(=O)N(C(=O)N1)CC(C2=CC=CC=C2)O)C3=C(C=CC(=C3)F)F
Gotenzyme_Smiles COc1ccc(S(=O)(=O)N(CC(C)C)C[C@@H](O)[C@H](Cc2ccccc2)NC(=O)O[C@H]2CO[C@H]3OCC[C@@H]23)cc1