生物智能计算平台


化合物信息

名称 内容
kegg编号 C15158
pubchemid 17396155
name 3alpha-Ethynyl-3-hydroxy-5alpha-androstan-17-one
formula C21H30O2
structure
Isomeric_Smiles C1CN(CCN1CC2=CC=CC3=C2N=CC=C3)S(=O)(=O)C4=C(C=C(C=C4)Br)Cl
Cannoical_Smiles C1CN(CCN1CC2=CC=CC3=C2N=CC=C3)S(=O)(=O)C4=C(C=C(C=C4)Br)Cl
Gotenzyme_Smiles C#C[C@]1(O)CC[C@@]2(C)[C@@H](CC[C@H]3[C@@H]4CCC(=O)[C@@]4(C)CC[C@@H]32)C1