PDB ligand accession: HY1
DrugBank: DB02178
PubChem:
ChEMBL:
InChI Key: DTUQWGWMVIHBKE-UHFFFAOYSA-N
SMILES: c1ccc(cc1)CC=O
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Benzenoids
- Class: Benzene and substituted derivatives
- Subclass: Phenylacetaldehydes
- Class: Benzene and substituted derivatives
- Superclass: Benzenoids
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
2I0S | Download | Experimental | e2i0sB1 e2i0sA1 | beta-propeller-like beta-propeller-like | LigPlot |