PDB ligand accession: 2XK
DrugBank: n/a
PubChem:
ChEMBL: n/a
InChI Key: IDNLSCLFQWBBHS-UHFFFAOYSA-N
SMILES: COc1cc(c(cc1OC)[N+](=O)[O-])CC(=O)c2ccc(cc2)C#N
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Phenylpropanoids and polyketides
- Class: Stilbenes
- Subclass: None
- Class: Stilbenes
- Superclass: Phenylpropanoids and polyketides
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
4PDW | Download | Experimental | e4pdwA1 e4pdwC1 | jelly-roll jelly-roll | LigPlot |