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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 C10847
pubchemid 13030
name Benzoylecgonine
formula C16H19NO4
structure
Isomeric_Smiles CC(=CC1=CC=CC=C1)C
Cannoical_Smiles CC(=CC1=CC=CC=C1)C
Gotenzyme_Smiles CN1C2CCC1[C@@H](C(=O)O)[C@@H](OC(=O)c1ccccc1)C2