| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| EPA CompTox | DTXSID20220586 |
| InChI Key | AYBWQZGGKFGQLB-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C14H20O5 |
| Molecular Weight | 268.13 |
| AlogP | 2.21 |
| Hydrogen Bond Acceptor | 5.0 |
| Number of Rotational Bond | 7.0 |
| Polar Surface Area | 53.99 |
| Heavy Atoms | 19.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 70311-20-5 |
| NORMAN SUSDAT | |
| PubChem | 622665 |
| ChemSpider | 540988.0 |