PDB ligand accession: DCB
DrugBank: DB04086
PubChem:
ChEMBL: n/a
InChI Key: WFVCNOHOODVBQK-IUBYCILNSA-N
SMILES: c1cc(c(cc1[N+](=O)[O-])[N+](=O)[O-])OC2C(C(C(C(O2)CO)OC3C(C(C(C(O3)CO)O)O)O)O)F
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organic oxygen compounds
- Class: Organooxygen compounds
- Subclass: Carbohydrates and carbohydrate conjugates
- Class: Organooxygen compounds
- Superclass: Organic oxygen compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
1H2J | Download | Experimental | e1h2jA1 | TIM beta/alpha-barrel | LigPlot |