生物智能计算平台

化合物信息

名称 内容
kegg编号 C10417
pubchemid 12603
name Deguelin
formula C23H22O6
structure
Isomeric_Smiles CC[NH+](CC)CCC1=C(C2=C(C=C(C=C2)OCC(=O)OCC)OC1=O)C.[Cl-]
Cannoical_Smiles CC[NH+](CC)CCC1=C(C2=C(C=C(C=C2)OCC(=O)OCC)OC1=O)C.[Cl-]
Gotenzyme_Smiles COc1cc2c(cc1OC)[C@@H]1C(=O)c3ccc4c(c3O[C@@H]1CO2)C=CC(C)(C)O4