PDB ligand accession: BTW
DrugBank: n/a
PubChem:
ChEMBL: n/a
InChI Key: LYLMADGMEFUMHJ-PSASIEDQSA-N
SMILES: CC(C(Cc1ccccc1)C(=O)O)S
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Phenylpropanoids and polyketides
- Class: Phenylpropanoic acids
- Subclass: None
- Class: Phenylpropanoic acids
- Superclass: Phenylpropanoids and polyketides
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
3I1U | Download | Experimental | e3i1uA1 | Phosphorylase/hydrolase-like | LigPlot |