生物智能计算平台

化合物信息

名称 内容
kegg编号 C12262
pubchemid 14407
name 4,4-Disubstituted cyclohexenone
formula C19H25NO5
structure
Isomeric_Smiles CN(C)CCCC1C2=C(CSC3=C1C=C(C=C3)Cl)C=CC(=C2)Cl
Cannoical_Smiles CN(C)CCCC1C2=C(CSC3=C1C=C(C=C3)Cl)C=CC(=C2)Cl
Gotenzyme_Smiles COC(=O)N(C)CC[C@@]1(c2ccc(OC)c(OC)c2)C=CC(=O)CC1