PDB ligand accession: 6ZY
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: SHGFQSFSJDFZLK-UHFFFAOYSA-N
SMILES: Cc1c(oc2c1cc3c(c2)OC(=O)C(=C3C)CCC(=O)N4CCCCC4)C
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Phenylpropanoids and polyketides
- Class: Coumarins and derivatives
- Subclass: Furanocoumarins
- Class: Coumarins and derivatives
- Superclass: Phenylpropanoids and polyketides
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
5L2M | Download | Experimental | e5l2mA1 e5l2mA2 | ALDH-like ALDH-like | LigPlot |