PDB ligand accession: AI1
DrugBank: DB03446
PubChem:
ChEMBL: n/a
InChI Key: FSMWGHKWKYCPKE-QTVCLEQKSA-N
SMILES: c1ccc(cc1)CNC(=O)c2cccc(c2)OC3C(C(C(C(O3)CO)O)O)O
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Benzenoids
- Class: Benzene and substituted derivatives
- Subclass: Benzoic acids and derivatives
- Class: Benzene and substituted derivatives
- Superclass: Benzenoids
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
1FD7 | Download | Experimental | e1fd7D1 e1fd7E1 e1fd7F1 e1fd7E1 e1fd7F1 e1fd7G1 e1fd7G1 e1fd7H1 e1fd7D1 e1fd7M1 e1fd7L1 e1fd7M1 e1fd7O1 e1fd7N1 e1fd7O1 e1fd7P1 e1fd7L1 e1fd7P1 | OB-fold OB-fold OB-fold OB-fold OB-fold OB-fold OB-fold OB-fold OB-fold OB-fold OB-fold OB-fold OB-fold OB-fold OB-fold OB-fold OB-fold OB-fold | LigPlot |