| 名称 | 内容 |
|---|---|
| kegg编号 | C07589 |
| pubchemid | 9791 |
| name | Celecoxib |
| formula | C17H14F3N3O2S |
| structure |  |
| Isomeric_Smiles | CC12CCC(=O)C=C1CCC3C2C(=O)CC4(C3CCC4=O)C |
| Cannoical_Smiles | CC12CCC(=O)C=C1CCC3C2C(=O)CC4(C3CCC4=O)C |
| Gotenzyme_Smiles | Cc1ccc(-c2cc(C(F)(F)F)nn2-c2ccc(S(N)(=O)=O)cc2)cc1 |
