| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | Y117KBL7C6 |
| EPA CompTox | DTXSID5059329 |
| InChI Key | GVRNUDCCYWKHMV-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C12H22O6 |
| Molecular Weight | 262.14 |
| AlogP | 0.93 |
| Hydrogen Bond Acceptor | 6.0 |
| Number of Rotational Bond | 11.0 |
| Polar Surface Area | 71.06 |
| Heavy Atoms | 18.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 106-00-3 |
| NORMAN SUSDAT | |
| FDA SRS | Y117KBL7C6 |
| PubChem | 66046 |
| ChemSpider | 59437.0 |