生物智能计算平台

化合物信息

名称 内容
kegg编号 C19371
pubchemid 124490043
name CI Acid Orange 20
formula C16H11N2O4S. Na
structure
Isomeric_Smiles C[C@H]1C[C@@H]2[C@@H](CC[C@@]3([C@@H]2C[C@@]4([C@]3(O4)C(=O)C)C)C)[C@@]5(C1=CC(=O)CC5)C
Cannoical_Smiles CC1CC2C(CCC3(C2CC4(C3(O4)C(=O)C)C)C)C5(C1=CC(=O)CC5)C
Gotenzyme_Smiles O=S(=O)([O-])c1ccc(/N=N/c2ccc(O)c3ccccc23)cc1.[Na+]