Ligand name: (7S)-1,2,3,10-tetramethoxy-7-(methylamino)-6,7-dihydro-5H-benzo[a]heptalen-9-one
PDB ligand accession: LON
DrugBank: DB13318
PubChem: 220401
ChEMBL: CHEMBL312862
InChI Key: NNJPGOLRFBJNIW-HNNXBMFYSA-N
SMILES: CNC1CCc2cc(c(c(c2C3=CC=C(C(=O)C=C13)OC)OC)OC)OC
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Hydrocarbon derivatives
    • Class: Tropones
      • Subclass: None

List of PDB structures and/or AlphaFold models with target protein Q2XVP4

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
5XKE	Download	Experimental	e5xkeA1 e5xkeA2 e5xkeB1 e5xkeB2 e5xkeD1 e5xkeD2 e5xkeC2	Rossmann-like Bacillus chorismate mutase-like Bacillus chorismate mutase-like Rossmann-like Bacillus chorismate mutase-like Rossmann-like Rossmann-like	LigPlot