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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 C14970
pubchemid 17395968
name 2alpha-(Hydroxymethyl)-5alpha-androstane-3beta,17beta-diol
formula C20H34O3
structure
Isomeric_Smiles CC(C)C(C(=O)NC1=CC(=C(C=C1)OC)S(=O)(=O)N2CCCCC2)NC(=O)C3CCCCC3
Cannoical_Smiles CC(C)C(C(=O)NC1=CC(=C(C=C1)OC)S(=O)(=O)N2CCCCC2)NC(=O)C3CCCCC3
Gotenzyme_Smiles C[C@]12CC[C@H]3[C@@H](CC[C@H]4C[C@@H](O)[C@H](CO)C[C@@]43C)[C@@H]1CC[C@@H]2O