PDB ligand accession: KAR
DrugBank: DB02868
PubChem:
ChEMBL: n/a
InChI Key: NUXKIZBEPYVRKP-RWBWKAGLSA-N
SMILES: CCC1(CC2CC(c3c(c4ccccc4[nH]3)CCN(C2)C1)(c5cc6c(cc5OC)N(C7C68CCN9C8C(CC71C(=O)N(C(=O)O1)CCCl)(C=CC9)CC)C)C(=O)OC)O
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Alkaloids and derivatives
- Class: Vinca alkaloids
- Subclass: None
- Class: Vinca alkaloids
- Superclass: Alkaloids and derivatives
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
1XA5 | Download | Experimental | e1xa5A1 e1xa5A2 | EF-hand EF-hand | LigPlot |