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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 C18362
pubchemid 124489036
name Tepoxalin
formula C20H20ClN3O3
structure
Isomeric_Smiles C[C@](CC1=CC=C(C=C1)OC)(CO)N
Cannoical_Smiles CC(CC1=CC=C(C=C1)OC)(CO)N
Gotenzyme_Smiles COc1ccc(-n2nc(CCC(=O)N(C)O)cc2-c2ccc(Cl)cc2)cc1