PDB ligand accession: V48
DrugBank: n/a
PubChem:
ChEMBL: n/a
InChI Key: MGGKYUHZRNHYQB-UHFFFAOYSA-N
SMILES: COc1cccc(c1)CC(=O)Oc2cc(ccc2[N+](=O)[O-])C=O
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Benzenoids
- Class: Benzene and substituted derivatives
- Subclass: Nitrobenzenes
- Class: Benzene and substituted derivatives
- Superclass: Benzenoids
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
7O6J | Download | Experimental | e7o6jA1 | Repetitive alpha hairpins | LigPlot |