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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 C18592
pubchemid 124489266
name Pentoxazone
formula C17H17ClFNO4
structure
Isomeric_Smiles CNC[C@H]1CCN(C1)C(=O)C2=CC3=C(C=C2)OCC3
Cannoical_Smiles CNCC1CCN(C1)C(=O)C2=CC3=C(C=C2)OCC3
Gotenzyme_Smiles CC(C)=C1OC(=O)N(c2cc(OC3CCCC3)c(Cl)cc2F)C1=O