PDB ligand accession: 3AJ
DrugBank: n/a
PubChem:
ChEMBL: n/a
InChI Key: XRVHRGHHDVJYGR-IPBGMLIISA-N
SMILES: CC(CCCC(C)(C)O)C1CCC2C1(CCCC2=CC=C3CC(C(C(C3=C)O)OCC4(CC4)C#N)O)C
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Lipids and lipid-like molecules
- Class: Steroids and steroid derivatives
- Subclass: Vitamin D and derivatives
- 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 |
---|---|---|---|---|---|
3WWR | Download | Experimental | e3wwrA1 | Nuclear receptor ligand-binding domain | LigPlot |