PDB ligand accession: 2KO
DrugBank: n/a
PubChem:
ChEMBL: n/a
InChI Key: NMXJNHVQXYBXDU-ZOLSBRMLSA-N
SMILES: CCN(CC)c1ccc2c(c1)Oc3cc(ccc3C2c4ccccc4C(=O)OCCOCCOCCOCCn5cc(nn5)COC6C(C(C(C(O6)CO)O)O)O)N(CC)CC
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Benzopyrans
- Subclass: 1-benzopyrans
- Class: Benzopyrans
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
5Z5Y | Download | Experimental | e5z5yA1 e5z5yB1 | jelly-roll jelly-roll | LigPlot |
4P9Y | Download | Experimental | e4p9yA1 e4p9yB1 | jelly-roll jelly-roll | LigPlot |