PDB ligand accession: AP1
DrugBank: DB01723
PubChem:
ChEMBL:
InChI Key: XCCRAOPQCACRFC-OIFRRMEBSA-N
SMILES: CCC(c1cc(c(c(c1)OC)OC)OC)C(=O)N2CCCCC2C(=O)OC(CCc3ccc(c(c3)OC)OC)c4cccc(c4)OCC(=O)O
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Phenylpropanoids and polyketides
- Class: Linear 1,3-diarylpropanoids
- Subclass: None
- Class: Linear 1,3-diarylpropanoids
- Superclass: Phenylpropanoids and polyketides
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
1BL4 | Download | Experimental | e1bl4A1 | FKBP-like | LigPlot |