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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 C01769
pubchemid 4902
name (S)-Acetoin
formula C4H8O2
structure
Isomeric_Smiles CC(=O)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)OS(=O)(=O)[O-])C)C
Cannoical_Smiles CC(=O)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)OS(=O)(=O)[O-])C)C
Gotenzyme_Smiles CC(=O)[C@H](C)O