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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 C16479
pubchemid 47205775
name 5-Fluorocyclohexadiene-cis,cis-1,2-diol-1-carboxylate
formula C7H7FO4
structure
Isomeric_Smiles CCOC(=O)NC(C(C)C)C(=O)NC1=CN=CC=C1
Cannoical_Smiles CCOC(=O)NC(C(C)C)C(=O)NC1=CN=CC=C1
Gotenzyme_Smiles O=C(O)[C@]1(O)C=C(F)C=C[C@H]1O