PDB ligand accession: 31R
DrugBank: n/a
PubChem:
ChEMBL: n/a
InChI Key: ANHFSWPHLAPWBN-UHFFFAOYSA-N
SMILES: c1ccc(cc1)C2=CC(=O)Oc3c2cc(c(c3)O)CCC(=O)O
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Phenylpropanoids and polyketides
- Class: Neoflavonoids
- Subclass: Neoflavones
- Class: Neoflavonoids
- Superclass: Phenylpropanoids and polyketides
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
4QFD | Download | Experimental | e4qfdA1 e4qfdA2 e4qfdB1 e4qfdB2 | Rossmann-like FAD-linked reductases, C-terminal domain-like Rossmann-like FAD-linked reductases, C-terminal domain-like | LigPlot |