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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 C03500
pubchemid 6312
name Ethyl 3-oxobutanoate
formula C6H10O3
structure
Isomeric_Smiles CNC(=NC)NCC1=CC=CC=C1Cl.CNC(=NC)NCC1=CC=CC=C1Cl.OS(=O)(=O)O
Cannoical_Smiles CNC(=NC)NCC1=CC=CC=C1Cl.CNC(=NC)NCC1=CC=CC=C1Cl.OS(=O)(=O)O
Gotenzyme_Smiles CCOC(=O)CC(C)=O