PDB ligand accession: 08N
DrugBank: DB06174
PubChem:
ChEMBL:
InChI Key: AKNNEGZIBPJZJG-MSOLQXFVSA-N
SMILES: CN1CCc2cc3c(c(c2C1C4c5ccc(c(c5C(=O)O4)OC)OC)OC)OCO3
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Alkaloids and derivatives
- Class: Phthalide isoquinolines
- Subclass: None
- Class: Phthalide isoquinolines
- Superclass: Alkaloids and derivatives
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
7N4Z | Download | Experimental | e7n4zA1 e7n4zA2 e7n4zC1 e7n4zC2 e7n4zB1 e7n4zB2 e7n4zD1 e7n4zD2 | HTH Tetracyclin repressor-like, C-terminal domain Tetracyclin repressor-like, C-terminal domain HTH HTH Tetracyclin repressor-like, C-terminal domain HTH Tetracyclin repressor-like, C-terminal domain | LigPlot |