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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 C04052
pubchemid 6753
name 5-Carboxy-2-oxohept-3-enedioate
formula C8H8O7
structure
Isomeric_Smiles CC1=C(C=C(C(=C1[N+](=O)[O-])OC)C(C)(C)C)[N+](=O)[O-]
Cannoical_Smiles CC1=C(C=C(C(=C1[N+](=O)[O-])OC)C(C)(C)C)[N+](=O)[O-]
Gotenzyme_Smiles O=C(O)CC(/C=C\C(=O)C(=O)O)C(=O)O