| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| EPA CompTox | DTXSID20983604 |
Structure
| InChI Key | UYPVDAPQHYMIRL-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C9H18O5 |
| Molecular Weight | 206.12 |
| AlogP | 0.73 |
| Hydrogen Bond Acceptor | 5.0 |
| Number of Rotational Bond | 5.0 |
| Polar Surface Area | 46.15 |
| Heavy Atoms | 14.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 65057-97-8 |
| NORMAN SUSDAT | |
| PubChem | 3033323 |
CONTENTS
