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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 C18091
pubchemid 96024308
name Ethylnitronate
formula C2H4NO2
structure
Isomeric_Smiles CCOC(=O)CC[C@@H]1C2=C(CCN1)C=CC(=C2C)C
Cannoical_Smiles CCOC(=O)CCC1C2=C(CCN1)C=CC(=C2C)C
Gotenzyme_Smiles CC=[N+]([O-])[O-]