| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | G5GN2N2QMR |
| EPA CompTox | DTXSID901217297 |
Structure
| InChI Key | PUDIPIBJWKQFNR-PLNGDYQASA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C10H16O5 |
| Molecular Weight | 216.1 |
| AlogP | 0.42 |
| Hydrogen Bond Acceptor | 5.0 |
| Hydrogen Bond Donor | 1.0 |
| Number of Rotational Bond | 7.0 |
| Polar Surface Area | 72.83 |
| Heavy Atoms | 15.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 26469-34-1 |
| NORMAN SUSDAT | |
| FDA SRS | G5GN2N2QMR |
| PubChem | 6432866 |
CONTENTS
