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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 C09955
pubchemid 12141
name Ochratoxin A
formula C20H18ClNO6
structure
Isomeric_Smiles C1=CC=C(C=C1)COCCO
Cannoical_Smiles C1=CC=C(C=C1)COCCO
Gotenzyme_Smiles C[C@@H]1Cc2c(Cl)cc(C(=O)N[C@@H](Cc3ccccc3)C(=O)O)c(O)c2C(=O)O1