PDB ligand accession: CBW
DrugBank: DB13089
PubChem:
ChEMBL:
InChI Key: MPDGHEJMBKOTSU-YKLVYJNSSA-N
SMILES: CC1(C2CCC3(C(C2(CCC1O)C)C(=O)C=C4C3(CCC5(C4CC(CC5)(C)C(=O)O)C)C)C)C
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Lipids and lipid-like molecules
- Class: Prenol lipids
- Subclass: Triterpenoids
- Class: Prenol lipids
- Superclass: Lipids and lipid-like molecules
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
5C71 | Download | Experimental | e5c71A3 e5c71C1 | TIM beta/alpha-barrel TIM beta/alpha-barrel | LigPlot |