| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 4BY6T6Y8D1 |
| EPA CompTox | DTXSID7027627 |
Structure
| InChI Key | PSXCGTLGGVDWFU-UHFFFAOYNA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C3H6N2O6 |
| Molecular Weight | 166.02 |
| AlogP | -0.21 |
| Hydrogen Bond Acceptor | 6.0 |
| Number of Rotational Bond | 5.0 |
| Polar Surface Area | 104.74 |
| Heavy Atoms | 11.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 6423-43-4 |
| NORMAN SUSDAT | |
| FDA SRS | 4BY6T6Y8D1 |
| ChemSpider | 21472.0 |
CONTENTS
