PDB ligand accession: NOM
DrugBank: DB01668
PubChem:
ChEMBL: n/a
InChI Key: XUWPJKDMEZSVTP-UOSCCXBLSA-N
SMILES: CC1C2=C(C3C(O1)CC(=O)O3)C(=O)c4cccc(c4C2=O)O
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Phenylpropanoids and polyketides
- Class: Isochromanequinones
- Subclass: Benzoisochromanequinones
- Class: Isochromanequinones
- Superclass: Phenylpropanoids and polyketides
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
1N5V | Download | Experimental | e1n5vA1 | Alpha-beta plaits | LigPlot |