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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 C19063
pubchemid 124489735
name Isopropalin
formula C15H23N3O4
structure
Isomeric_Smiles COC(=O)[C@H]1CNN[C@@H]1C2=CC=C(C=C2)F
Cannoical_Smiles COC(=O)C1CNNC1C2=CC=C(C=C2)F
Gotenzyme_Smiles CCCN(CCC)c1c([N+](=O)[O-])cc(C(C)C)cc1[N+](=O)[O-]