PDB ligand accession: 7WR
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: KWCCUYSXAYTNKA-UHFFFAOYSA-N
SMILES: COc1cc(cc(c1O)O)C(=O)O
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Benzenoids
- Class: Benzene and substituted derivatives
- Subclass: Benzoic acids and derivatives
- Class: Benzene and substituted derivatives
- Superclass: Benzenoids
# | DrugDomain Data | UniProt Accession | Protein name | Drug Action | Affinity data |
---|---|---|---|---|---|
1 | G2IQS7_7WR | G2IQS7 | Vanillate/3-O-methylgallate O-demethylase (Vanillate/3MGA | n/a |