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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 C12834
pubchemid 583223
name 2,5-Dichloro-carboxymethylenebut-2-en-4-olide
formula C6H2Cl2O4
structure
Isomeric_Smiles CC12CCCC1C3CCC4CCC5(CC4(C3C(=O)C2)C)SCCS5
Cannoical_Smiles CC12CCCC1C3CCC4CCC5(CC4(C3C(=O)C2)C)SCCS5
Gotenzyme_Smiles O=C1O/C(=C(/Cl)C(=O)O)C=C1Cl