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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 C10744
pubchemid 12927
name Vasicinone
formula C11H10N2O2
structure
Isomeric_Smiles CC(C1=CC=CC=C1)ON=C(N)N.C1CCC(CC1)NS(=O)(=O)O
Cannoical_Smiles CC(C1=CC=CC=C1)ON=C(N)N.C1CCC(CC1)NS(=O)(=O)O
Gotenzyme_Smiles O=c1c2ccccc2nc2n1CC[C@@H]2O