化合物信息

名称	内容
kegg编号	C01588
pubchemid	4743
name	Ibuprofen
formula	C13H18O2
structure
Isomeric_Smiles	CC(C)CC(C(CC(=O)O)O)NC(=O)C(C)NC(=O)CC(C(CC(C)C)NC(=O)C(C(C)C)NC(=O)C(CC(C)C)NC(=O)C(C)C)O
Cannoical_Smiles	CC(C)CC(C(CC(=O)O)O)NC(=O)C(C)NC(=O)CC(C(CC(C)C)NC(=O)C(C(C)C)NC(=O)C(CC(C)C)NC(=O)C(C)C)O
Gotenzyme_Smiles	CC(C)Cc1ccc(C(C)C(=O)O)cc1