| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| EPA CompTox | DTXSID00938753 |
| InChI Key | PFCRQPBOOFTZGQ-RGXJTGTOSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C12H22O11 |
| Molecular Weight | 342.12 |
| AlogP | -5.55 |
| Hydrogen Bond Acceptor | 11.0 |
| Hydrogen Bond Donor | 8.0 |
| Number of Rotational Bond | 8.0 |
| Polar Surface Area | 197.37 |
| Heavy Atoms | 23.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 17606-72-3 |
| NORMAN SUSDAT | |
| PubChem | 87177 |