PDB ligand accession: DBX
DrugBank: DB13529
PubChem:
ChEMBL:
InChI Key: IKQCSJBQLWJEPU-UHFFFAOYSA-N
SMILES: c1cc(c(cc1O)S(=O)(=O)O)O
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Benzenoids
- Class: Benzene and substituted derivatives
- Subclass: Benzenesulfonic acids and derivatives
- Class: Benzene and substituted derivatives
- Superclass: Benzenoids
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
3K1X | Download | Experimental | e3k1xA1 e3k1xC1 e3k1xB1 | beta-Trefoil beta-Trefoil beta-Trefoil | LigPlot |