PDB ligand accession: 6JP
DrugBank: DB01094
PubChem:
ChEMBL:
InChI Key: AIONOLUJZLIMTK-AWEZNQCLSA-N
SMILES: COc1ccc(cc1O)C2CC(=O)c3c(cc(cc3O2)O)O
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Phenylpropanoids and polyketides
- Class: Flavonoids
- Subclass: O-methylated flavonoids
- Class: Flavonoids
- Superclass: Phenylpropanoids and polyketides
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
7POU | Download | Experimental | e7pouA1 e7pouB2 e7pouA1 e7pouA2 e7pouB1 | Zincin-like Fragilysin-3 prodomain-like Zincin-like Fragilysin-3 prodomain-like Zincin-like | LigPlot |