PDB ligand accession: JBR
DrugBank: n/a
PubChem: 8546;20483198;54742459;
ChEMBL:
InChI Key: WLJNZVDCPSBLRP-UHFFFAOYSA-N
SMILES: c1ccc2c(c1)cc(c(c2Cc3c4ccccc4cc(c3O)C(=O)O)O)C(=O)O
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Benzenoids
- Class: Naphthalenes
- Subclass: Naphthalenecarboxylic acids and derivatives
- Class: Naphthalenes
- Superclass: Benzenoids
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
7ERE | Download | Experimental | e7ereA1 e7ereB1 e7ereC1 e7ereC1 e7ereD1 | Rossmann-like Rossmann-like Rossmann-like Rossmann-like Rossmann-like | LigPlot |