PDB ligand accession: DMC
DrugBank: DB07668
PubChem:
ChEMBL: n/a
InChI Key: JAEWDFYDSACHDN-CSKARUKUSA-N
SMILES: CCN(CC)c1ccc(c(c1)O)C=C(C)C(=O)O
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Phenylpropanoids and polyketides
- Class: Cinnamic acids and derivatives
- Subclass: Hydroxycinnamic acids and derivatives
- Class: Cinnamic acids and derivatives
- Superclass: Phenylpropanoids and polyketides
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
4GCH | Download | Experimental | e4gch.3 | cradle loop barrel | LigPlot |