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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 C08423
pubchemid 10618
name 4-Methoxyglucobrassicin
formula C17H22N2O10S2
structure
Isomeric_Smiles CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC
Cannoical_Smiles CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC
Gotenzyme_Smiles COc1cccc2[nH]cc(CC(=NOS(=O)(=O)O)S[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c12