PDB ligand accession: NIY
DrugBank: DB03867
PubChem: 65124;51671208;
ChEMBL:
InChI Key: FBTSQILOGYXGMD-LURJTMIESA-N
SMILES: c1cc(c(cc1CC(C(=O)O)N)[N+](=O)[O-])O
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organic acids and derivatives
- Class: Carboxylic acids and derivatives
- Subclass: Amino acids, peptides, and analogues
- Class: Carboxylic acids and derivatives
- Superclass: Organic acids and derivatives
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
6WRT | Download | Experimental | e6wrtA1 | HUP domain-like | LigPlot |
6WRN | Download | Experimental | e6wrnA1 | HUP domain-like | LigPlot |
4NDA | Download | Experimental | e4ndaA1 | HUP domain-like | LigPlot |
6WRK | Download | Experimental | e6wrkA1 | HUP domain-like | LigPlot |
6WRQ | Download | Experimental | e6wrqA1 | HUP domain-like | LigPlot |