| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 3D2Y91QZ2H |
Structure
| InChI Key | UCYLROVJSUACAD-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C9H20O6 |
| Molecular Weight | 224.13 |
| AlogP | -1.62 |
| Hydrogen Bond Acceptor | 6.0 |
| Hydrogen Bond Donor | 3.0 |
| Number of Rotational Bond | 11.0 |
| Polar Surface Area | 88.38 |
| Heavy Atoms | 15.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 31694-55-0 |
| NORMAN SUSDAT | |
| FDA SRS | 3D2Y91QZ2H |
| PubChem | 88802 |
| ChemSpider | 80131.0 |
CONTENTS
