PDB ligand accession: SEM
DrugBank: DB02148
PubChem: 78457;6923806;
ChEMBL: n/a
InChI Key: IDGQXGPQOGUGIX-VIFPVBQESA-N
SMILES: c1ccc(cc1)COCC(C(=O)O)N
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organic acids and derivatives
- Class: Carboxylic acids and derivatives
- Subclass: Amino acids, peptides, and analogues
- Class: Carboxylic acids and derivatives
- Superclass: Organic acids and derivatives
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
6BI1 | Download | Experimental | e6bi1A1 | Phosphorylase/hydrolase-like | LigPlot |