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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 C16215
pubchemid 47205523
name 1,2-Dihydrophthalic acid
formula C8H8O4
structure
Isomeric_Smiles C1=CC(=CC(=C1)NC(=O)C2=CC=C(O2)S(=O)(=O)N)C#N
Cannoical_Smiles C1=CC(=CC(=C1)NC(=O)C2=CC=C(O2)S(=O)(=O)N)C#N
Gotenzyme_Smiles O=C(O)C1C=CC=CC1C(=O)O