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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 C15089
pubchemid 17396086
name 1,6-Dihydro-1-(3-methoxyphenethyl)-6-oxonicotinic acid
formula C15H15NO4
structure
Isomeric_Smiles CC(C1=NN=C(O1)C2=CC(=CC=C2)Cl)N3CCN(CC3)CC4=CC=CC5=CC=CC=C54
Cannoical_Smiles CC(C1=NN=C(O1)C2=CC(=CC=C2)Cl)N3CCN(CC3)CC4=CC=CC5=CC=CC=C54
Gotenzyme_Smiles COc1cccc(CCn2cc(C(=O)O)ccc2=O)c1