PDB ligand accession: C0R
DrugBank: DB04652
PubChem:
ChEMBL:
InChI Key: OMFXVFTZEKFJBZ-HJTSIMOOSA-N
SMILES: CC12CCC(=O)C=C1CCC3C2C(CC4(C3CCC4C(=O)CO)C)O
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Lipids and lipid-like molecules
- Class: Steroids and steroid derivatives
- Subclass: Hydroxysteroids
- Class: Steroids and steroid derivatives
- Superclass: Lipids and lipid-like molecules
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
1Y5R | Download | Experimental | e1y5rA1 e1y5rB1 e1y5rB1 | Rossmann-like Rossmann-like Rossmann-like | LigPlot |