| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 54BB3B7XMZ |
| EPA CompTox | DTXSID60893379 |
Structure
| InChI Key | MPCAJMNYNOGXPB-SLPGGIOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C6H12O5 |
| Molecular Weight | 164.07 |
| AlogP | -2.54 |
| Hydrogen Bond Acceptor | 5.0 |
| Hydrogen Bond Donor | 4.0 |
| Number of Rotational Bond | 1.0 |
| Polar Surface Area | 90.15 |
| Heavy Atoms | 11.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 154-58-5 |
| NORMAN SUSDAT | |
| FDA SRS | 54BB3B7XMZ |
| PubChem | 64960 |
| ChemSpider | 58485.0 |
CONTENTS
