Ligand name: 2-MERCAPTO-N-[1,2,3,10-TETRAMETHOXY-9-OXO-5,6,7,9-TETRAHYDRO-BENZO[A]HEPTALEN-7-YL]ACETAMIDE
PDB ligand accession: CN2
DrugBank: DB07574
PubChem: 5287955
ChEMBL: n/a
InChI Key: TYDIWMTWTXFWSY-HNNXBMFYSA-N
SMILES: COc1cc2c(c(c1OC)OC)C3=CC=C(C(=O)C=C3C(CC2)NC(=O)CS)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 P02554

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
1SA0	Download	Experimental	e1sa0A1 e1sa0B1 e1sa0B2 e1sa0A2 e1sa0D1 e1sa0D2 e1sa0C2	Bacillus chorismate mutase-like Bacillus chorismate mutase-like Rossmann-like Rossmann-like Bacillus chorismate mutase-like Rossmann-like Rossmann-like	LigPlot
3EDL	Download	Experimental	e3edlG1 e3edlG2 e3edlF2	Bacillus chorismate mutase-like Rossmann-like Rossmann-like	LigPlot