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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 C12186
pubchemid 14332
name Pancracine
formula C16H17NO4
structure
Isomeric_Smiles COC1=CC(=CC(=C1)C(=O)O)OC
Cannoical_Smiles COC1=CC(=CC(=C1)C(=O)O)OC
Gotenzyme_Smiles O[C@H]1C=C2[C@H]3C[N@](Cc4cc5c(cc43)OCO5)[C@H]2C[C@@H]1O