PDB ligand accession: D72
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: FQKMILFVTQADHR-CYBMUJFWSA-N
SMILES: CC(C)COc1c(cc2c(c1Cl)OC(C(=C2)C(=O)O)C(F)(F)F)Cl
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Benzopyrans
- Subclass: 1-benzopyrans
- Class: Benzopyrans
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
3NTG | Download | Experimental | e3ntgA1 e3ntgB1 e3ntgC1 e3ntgD1 | Heme-dependent peroxidases Heme-dependent peroxidases Heme-dependent peroxidases Heme-dependent peroxidases | LigPlot |