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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 C15346
pubchemid 17396343
name 5alpha-Androstane-3beta,17beta-diol diacetate
formula C23H36O4
structure
Isomeric_Smiles CC(=O)NC1=NC(=CS1)COC(=O)C2=CC3=C(S2)CCCC3
Cannoical_Smiles CC(=O)NC1=NC(=CS1)COC(=O)C2=CC3=C(S2)CCCC3
Gotenzyme_Smiles CC(=O)O[C@H]1CC[C@@]2(C)[C@@H](CC[C@@H]3[C@@H]2CC[C@]2(C)[C@@H](OC(C)=O)CC[C@@H]32)C1