PDB ligand accession: 2UO
DrugBank: DB06693
PubChem:
ChEMBL:
InChI Key: AJLFOPYRIVGYMJ-INTXDZFKSA-N
SMILES: CCC(C)C(=O)OC1CCC=C2C1C(C(C=C2)C)CCC3CC(CC(=O)O3)O
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Lactones
- Subclass: Delta valerolactones
- Class: Lactones
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
4OQR | Download | Experimental | e4oqrA1 | Cytochrome P450 | LigPlot |