| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | B8Q5SRV5C9 |
| EPA CompTox | DTXSID50203069 |
Structure
| InChI Key | YFBFTGJJUOXWIC-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C10H14O8 |
| Molecular Weight | 262.07 |
| AlogP | -1.09 |
| Hydrogen Bond Acceptor | 8.0 |
| Number of Rotational Bond | 5.0 |
| Polar Surface Area | 105.2 |
| Heavy Atoms | 18.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 5464-22-2 |
| NORMAN SUSDAT | |
| FDA SRS | B8Q5SRV5C9 |
| PubChem | 79589 |
| ChemSpider | 71896.0 |
CONTENTS
