| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | T6EKB9V2O2 |
| EPA CompTox | DTXSID40204060 |
| InChI Key | HSJFYRYGGKLQBT-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C16H14O5 |
| Molecular Weight | 286.08 |
| AlogP | 2.84 |
| Hydrogen Bond Acceptor | 5.0 |
| Number of Rotational Bond | 4.0 |
| Polar Surface Area | 61.83 |
| Heavy Atoms | 21.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 55482-89-8 |
| NORMAN SUSDAT | |
| FDA SRS | T6EKB9V2O2 |
| PubChem | 68749 |
| ChemSpider | 61994.0 |