| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 9B1VBE526I |
| EPA CompTox | DTXSID101014653 |
| InChI Key | DLRVVLDZNNYCBX-ZZFZYMBESA-N |
|---|---|
| Smiles | |
| InChI |
|
| 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 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 585-99-9 |
| NORMAN SUSDAT | |
| FDA SRS | 9B1VBE526I |
| PubChem | 11458 |