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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 C10677
pubchemid 12860
name Febrifugine
formula C16H19N3O3
structure
Isomeric_Smiles CC(C)C1=CC(=CC(=C1)C(C)C)C(C)C
Cannoical_Smiles CC(C)C1=CC(=CC(=C1)C(C)C)C(C)C
Gotenzyme_Smiles O=C(C[C@@H]1NCCC[C@H]1O)Cn1cnc2ccccc2c1=O