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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 C07425
pubchemid 9629
name Pergolide
formula C19H26N2S
structure
Isomeric_Smiles C(=O)(C(Cl)(Cl)Cl)F
Cannoical_Smiles C(=O)(C(Cl)(Cl)Cl)F
Gotenzyme_Smiles CCCN1C[C@H](CSC)C[C@@H]2c3cccc4[nH]cc(c34)C[C@H]21