PDB ligand accession: A6O
DrugBank: n/a
PubChem:
ChEMBL: n/a
InChI Key: ZXYHLOFRRMDJAQ-OUBQQWGRSA-N
SMILES: CCC1(C(CCC1=O)O)CC=C2CCCc3c2ccc(c3)OC
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Benzenoids
- Class: Tetralins
- Subclass: None
- Class: Tetralins
- Superclass: Benzenoids
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
6IHI | Download | Experimental | e6ihiA1 e6ihiC1 | Rossmann-like Rossmann-like | LigPlot |
6IHH | Download | Experimental | e6ihhA1 | Rossmann-like | LigPlot |