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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 C03197
pubchemid 6074
name (S)-3-Hydroxybutanoate
formula C4H8O3
structure
Isomeric_Smiles CC[N+](C)(C)C(C)CN1C2=CC=CC=C2SC3=CC=CC=C31
Cannoical_Smiles CC[N+](C)(C)C(C)CN1C2=CC=CC=C2SC3=CC=CC=C31
Gotenzyme_Smiles C[C@H](O)CC(=O)O