PDB ligand accession: SH7
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: BZDNWZYKPRTPIF-UHFFFAOYSA-N
SMILES: Cc1ccc2c(c1)C=C(C(=O)O2)C(=O)Oc3cccc(c3)Cl
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Phenylpropanoids and polyketides
- Class: Coumarins and derivatives
- Subclass: None
- Class: Coumarins and derivatives
- Superclass: Phenylpropanoids and polyketides
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
6SHH | Download | Experimental | e6shhA1 e6shhB1 e6shhC1 e6shhE1 e6shhD1 e6shhH1 e6shhF1 e6shhG1 | cradle loop barrel cradle loop barrel cradle loop barrel cradle loop barrel cradle loop barrel cradle loop barrel cradle loop barrel cradle loop barrel | LigPlot |