PDB ligand accession: CTI
DrugBank: DB17024
PubChem:
ChEMBL:
InChI Key: LLEJIEBFSOEYIV-UHFFFAOYSA-N
SMILES: C[n+]1cc2c(ccc(c2OC)OC)c3c1c4cc5c(cc4cc3)OCO5
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Alkaloids and derivatives
- Class: Benzophenanthridine alkaloids
- Subclass: Quaternary benzophenanthridine alkaloids
- Class: Benzophenanthridine alkaloids
- Superclass: Alkaloids and derivatives
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
4Y29 | Download | Experimental | e4y29A1 | Nuclear receptor ligand-binding domain | LigPlot |