PDB ligand accession: 6ZW
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: AFYCEAFSNDLKSX-UHFFFAOYSA-N
SMILES: CCN(CC)c1ccc2c(c1)OC(=O)C=C2C
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Phenylpropanoids and polyketides
- Class: Coumarins and derivatives
- Subclass: None
- Class: Coumarins and derivatives
- Superclass: Phenylpropanoids and polyketides
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
5L2O | Download | Experimental | e5l2oA1 e5l2oB1 e5l2oC2 e5l2oD1 e5l2oE1 e5l2oF1 e5l2oG1 e5l2oH2 | ALDH-like ALDH-like ALDH-like ALDH-like ALDH-like ALDH-like ALDH-like ALDH-like | LigPlot |