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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 C07556
pubchemid 9759
name Rocuronium
formula C32H53N2O4
structure
Isomeric_Smiles CC(=O)SCCCCF
Cannoical_Smiles CC(=O)SCCCCF
Gotenzyme_Smiles C=CC[N+]1([C@H]2C[C@H]3[C@@H]4CC[C@H]5C[C@H](O)[C@@H](N6CCOCC6)C[C@]5(C)[C@H]4CC[C@]3(C)[C@H]2OC(C)=O)CCCC1