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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 C17167
pubchemid 96023608
name Eudistomin C
formula C14H16BrN3O2S
structure
Isomeric_Smiles CC1=CC=C(C=C1)CC[C@@H]2C3=CC(=C(C=C3CCN2)F)O
Cannoical_Smiles CC1=CC=C(C=C1)CCC2C3=CC(=C(C=C3CCN2)F)O
Gotenzyme_Smiles N[C@@H]1CSCON2CCc3c([nH]c4cc(Br)c(O)cc34)[C@H]12