| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 6D600ARY3R |
| EPA CompTox | DTXSID90876998 |
Structure
| InChI Key | SEWFWJUQVJHATO-UGDNZRGBSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C12H22O11 |
| Molecular Weight | 342.12 |
| AlogP | -5.4 |
| Hydrogen Bond Acceptor | 11.0 |
| Hydrogen Bond Donor | 8.0 |
| Number of Rotational Bond | 4.0 |
| Polar Surface Area | 189.53 |
| Heavy Atoms | 23.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 547-25-1 |
| NORMAN SUSDAT | |
| FDA SRS | 6D600ARY3R |
| PubChem | 10236867 |
CONTENTS
