PDB ligand accession: XCA
DrugBank: n/a
PubChem:
ChEMBL: n/a
InChI Key: NIQOQQMAUFLELB-KMPPVSSLSA-N
SMILES: CC(CCCC(C)C(=O)O)C1CCC2C1(CCC3C2CC=C4C3(CCC(=C4)O)C)C
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Lipids and lipid-like molecules
- Class: Steroids and steroid derivatives
- Subclass: Bile acids, alcohols 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 |
---|---|---|---|---|---|
3UP3 | Download | Experimental | e3up3A1 | Nuclear receptor ligand-binding domain | LigPlot |