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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 C18349
pubchemid 124489023
name 4-[2-(5-Carboxy-2-hydroxy-3-methoxyphenyl)-2-oxoethylidene]-2-hydroxy-2-pentenedioate
formula C15H12O10
structure
Isomeric_Smiles CC[C@H](C)CCC[C@H](C)Br
Cannoical_Smiles CCC(C)CCCC(C)Br
Gotenzyme_Smiles COc1cc(C(=O)O)cc(C(=O)/C=C(\C=C(\O)C(=O)O)C(=O)O)c1O