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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 C17874
pubchemid 163311875
name Uncaric acid A
formula C20H22N2O4
structure
Isomeric_Smiles C1COC2(CCN(CC2)C(=O)C3=CC(=NN3)C4=CC=CC=C4O)C5=C1SC=C5
Cannoical_Smiles C1COC2(CCN(CC2)C(=O)C3=CC(=NN3)C4=CC=CC=C4O)C5=C1SC=C5
Gotenzyme_Smiles C[C@H]1OC=C(C(=O)O)[C@H]2C[C@@H]3N(CCC34C(=O)Nc3ccccc34)C[C@@H]21