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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 C03975
pubchemid 6694
name Isoxanthopterin
formula C6H5N5O2
structure
Isomeric_Smiles CCN(CC)C1=CC2=C(C=C1)C(=C3C=CC(=[N+](CC)CC)C=C3O2)C4=CC=CC=C4C(=O)O.[Cl-]
Cannoical_Smiles CCN(CC)C1=CC2=C(C=C1)C(=C3C=CC(=[N+](CC)CC)C=C3O2)C4=CC=CC=C4C(=O)O.[Cl-]
Gotenzyme_Smiles Nc1nc(=O)c2ncc(=O)[nH]c2[nH]1