生物智能计算平台


化合物信息

名称 内容
kegg编号 C14594
pubchemid 17395594
name 3alpha,17alpha,21-Trihydroxy-5beta-pregnan-20-one
formula C21H34O4
structure
Isomeric_Smiles CN(CC1=CC=C(O1)C2=CC=C(C=C2)Cl)C(=O)CSC3=NN=C4N3CCCCC4
Cannoical_Smiles CN(CC1=CC=C(O1)C2=CC=C(C=C2)Cl)C(=O)CSC3=NN=C4N3CCCCC4
Gotenzyme_Smiles C[C@]12CC[C@@H](O)C[C@H]1CC[C@@H]1[C@@H]2CC[C@@]2(C)[C@H]1CC[C@]2(O)C(=O)CO