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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 C14804
pubchemid 17395802
name 1-Nitro-7-glutathionyl-8-hydroxy-7,8-dihydronaphthalene
formula C20H24N4O9S
structure
Isomeric_Smiles CN(CC1=NN=C(O1)C2=CC=C(C=C2)F)CC(=O)NC3=CC=C(C=C3)Cl
Cannoical_Smiles CN(CC1=NN=C(O1)C2=CC=C(C=C2)F)CC(=O)NC3=CC=C(C=C3)Cl
Gotenzyme_Smiles N[C@@H](CCC(=O)N[C@@H](CSC1C=Cc2cccc([N+](=O)[O-])c2C1O)C(=O)NCC(=O)O)C(=O)O