| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | RT5HZF5GY3 |
| EPA CompTox | DTXSID30201088 |
Structure
| InChI Key | RFHYWFVQMMSWHX-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C11H16O8 |
| Molecular Weight | 276.08 |
| AlogP | -0.56 |
| Hydrogen Bond Acceptor | 8.0 |
| Number of Rotational Bond | 6.0 |
| Polar Surface Area | 105.2 |
| Heavy Atoms | 19.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 53046-85-8 |
| NORMAN SUSDAT | |
| FDA SRS | RT5HZF5GY3 |
| PubChem | 104389 |
| ChemSpider | 94238.0 |
CONTENTS
