PDB ligand accession: G24
DrugBank: DB03788
PubChem:
ChEMBL: n/a
InChI Key: JYHIGYLGYNCMGI-UHFFFAOYSA-N
SMILES: Cc1cc(cc(c1Cc2ccc(c(c2)Cc3ccccc3)O)C)OCC(=O)O
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Phenylpropanoids and polyketides
- Class: Diarylheptanoids
- Subclass: Linear diarylheptanoids
- Class: Diarylheptanoids
- Superclass: Phenylpropanoids and polyketides
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
3NEO | Download | Experimental | e3neoA1 e3neoA1 e3neoB1 | Immunoglobulin-like beta-sandwich Immunoglobulin-like beta-sandwich Immunoglobulin-like beta-sandwich | LigPlot |
3NEX | Download | Experimental | e3nexA1 e3nexA1 e3nexB1 | Immunoglobulin-like beta-sandwich Immunoglobulin-like beta-sandwich Immunoglobulin-like beta-sandwich | LigPlot |