| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | PJ3J67R547 |
| EPA CompTox | DTXSID00223772 |
Structure
| InChI Key | QKQPBZPCABVALD-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C8H12O5 |
| Molecular Weight | 188.07 |
| AlogP | -0.12 |
| Hydrogen Bond Acceptor | 5.0 |
| Polar Surface Area | 61.83 |
| Heavy Atoms | 13.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 7357-94-0 |
| NORMAN SUSDAT | |
| FDA SRS | PJ3J67R547 |
| PubChem | 81819 |
CONTENTS
