生物智能计算平台


化合物信息

名称 内容
kegg编号 C15459
pubchemid 17396456
name 13-Hydroxy-2-(hydroxymethylene)-3-oxo-13,17-seco-5alpha-androstan-17-oic acid, delta-lactone
formula C20H28O4
structure
Isomeric_Smiles C1CN(CCN1CCOC2=CC=CC=C2)C(=O)C3=CC(=C(C=C3)O)Cl
Cannoical_Smiles C1CN(CCN1CCOC2=CC=CC=C2)C(=O)C3=CC(=C(C=C3)O)Cl
Gotenzyme_Smiles C[C@]12CC[C@H]3[C@@H](CC[C@H]4CC(=O)/C(=C\O)C[C@@]43C)[C@@H]1CCC(=O)O2