Ligand name: 3-[[(1~{S},3~{S})-3-methylcyclohexyl]methyl]-6,8-bis(oxidanyl)isochromen-1-one
PDB ligand accession: D5F
DrugBank: n/a
PubChem: 146018251
ChEMBL: n/a
InChI Key: JSPLICPLSKXJBM-QWRGUYRKSA-N
SMILES: CC1CCCC(C1)CC2=Cc3cc(cc(c3C(=O)O2)O)O
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Phenylpropanoids and polyketides
    • Class: Isocoumarins and derivatives
      • Subclass: None

List of PDB structures and/or AlphaFold models with target protein W7JP72

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
6KCN	Download	Experimental	e6kcnA1 e6kcnB2 e6kcnC1 e6kcnD1	Class II aaRS and biotin synthetases Class II aaRS and biotin synthetases Class II aaRS and biotin synthetases Class II aaRS and biotin synthetases	LigPlot