| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | PVX284APC6 |
| EPA CompTox | DTXSID5062007 |
Structure
| InChI Key | RNJOKCPFLQMDEC-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C7H10O5 |
| Molecular Weight | 174.05 |
| AlogP | -0.32 |
| Hydrogen Bond Acceptor | 5.0 |
| Number of Rotational Bond | 4.0 |
| Polar Surface Area | 69.67 |
| Heavy Atoms | 12.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 1830-54-2 |
| NORMAN SUSDAT | |
| FDA SRS | PVX284APC6 |
| PubChem | 74591 |
| ChemSpider | 67168.0 |
CONTENTS
