PDB ligand accession: MC9
DrugBank: DB02300
PubChem:
ChEMBL:
InChI Key: LWQQLNNNIPYSNX-UROSTWAQSA-N
SMILES: CC(C=CC(C1CC1)O)C2CCC3C2(CCCC3=CC=C4CC(CC(C4=C)O)O)C
Drug action: antagonist
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 |
---|---|---|---|---|---|
1S19 | Download | Experimental | e1s19A1 | Nuclear receptor ligand-binding domain | LigPlot |