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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 C02596
pubchemid 5587
name Tolylacetonitrile
formula C9H9N
structure
Isomeric_Smiles CN(C)CCN(CC1=CC=CC=C1)C2=CC=CC=N2
Cannoical_Smiles CN(C)CCN(CC1=CC=CC=C1)C2=CC=CC=N2
Gotenzyme_Smiles Cc1ccccc1CC#N