PDB ligand accession: EM9
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: FQJIZXBCOKNLMR-FTAPQOLWSA-N
SMILES: CCCCN(C)C(=O)CCCCCCCCCCC1Cc2cc(ccc2C3C1C4CC(C(C4(CC3)C)O)Cl)O
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Lipids and lipid-like molecules
- Class: Steroids and steroid derivatives
- Subclass: Estrane steroids
- 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 |
---|---|---|---|---|---|
6DTP | Download | Experimental | e6dtpA1 | Rossmann-like | LigPlot |