PDB ligand accession: SXC
DrugBank: n/a
PubChem: n/a
ChEMBL: n/a
InChI Key: UQJAYMPWLMSAFV-QDSLRZTOSA-M
SMILES: CCOP(=O)(CCCc1cc2c3c(c1)C[S+]([Pd]3([S+](C2)C)Br)C)Oc4ccc(cc4)[N+](=O)[O-]
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Benzenoids
- Class: Benzene and substituted derivatives
- Subclass: Nitrobenzenes
- Class: Benzene and substituted derivatives
- Superclass: Benzenoids
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
3ESC | Download | Experimental | e3escA1 | alpha/beta-Hydrolases | LigPlot |
3ESD | Download | Experimental | e3esdA1 | alpha/beta-Hydrolases | LigPlot |