| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | R9UK2G8Y79 |
| EPA CompTox | DTXSID80897218 |
Structure
| InChI Key | HWXBTNAVRSUOJR-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C5H8O5 |
| Molecular Weight | 148.04 |
| AlogP | -0.7 |
| Hydrogen Bond Acceptor | 3.0 |
| Hydrogen Bond Donor | 3.0 |
| Number of Rotational Bond | 4.0 |
| Polar Surface Area | 94.83 |
| Heavy Atoms | 10.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 13095-47-1 |
| NORMAN SUSDAT | |
| FDA SRS | R9UK2G8Y79 |
CONTENTS
