PDB ligand accession: 3LF
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: ZCYXGVJUZBKJAI-UHFFFAOYSA-N
SMILES: COc1cc(cc(c1OC)OC)CCC(=O)O
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 |
---|---|---|---|---|---|
5J41 | Download | Experimental | e5j41A1 e5j41A2 e5j41B1 e5j41B2 | Repetitive alpha hairpins Thioredoxin-like Thioredoxin-like Repetitive alpha hairpins | LigPlot |