| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 6X99UD6JTA |
| EPA CompTox | DTXSID0051572 |
Structure
| InChI Key | AGCQZYRSTIRJFM-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C6H12N2O8 |
| Molecular Weight | 240.06 |
| AlogP | -0.56 |
| Hydrogen Bond Acceptor | 8.0 |
| Number of Rotational Bond | 11.0 |
| Polar Surface Area | 123.2 |
| Heavy Atoms | 16.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 111-22-8 |
| NORMAN SUSDAT | |
| FDA SRS | 6X99UD6JTA |
| PubChem | 8099 |
| ChemSpider | 7808.0 |
CONTENTS
