PDB ligand accession: 4Q1
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: WEIYXEFMCIRZHC-MWGWWEMPSA-N
SMILES: CC(=CCn1c2cc(ccc2c3c1C(N4C(=O)C5CCCN5C(=O)C4(C3O)O)C=C(C)C)OC)C
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Indoles and derivatives
- Subclass: Pyridoindoles
- Class: Indoles and derivatives
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
7ETK | Download | Experimental | e7etkA1 e7etkB1 | jelly-roll jelly-roll | LigPlot |