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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 C14081
pubchemid 7846936
name CBS 113A
formula C10H10N2OS. HCl
structure
Isomeric_Smiles CC1=C(C2=CC=CC=C2N1)C(=O)COC(=O)CCC3=NC4=CC=CC=C4S3
Cannoical_Smiles CC1=C(C2=CC=CC=C2N1)C(=O)COC(=O)CCC3=NC4=CC=CC=C4S3
Gotenzyme_Smiles Cc1ccc(Nc2nccs2)c(O)c1.Cl