| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | U3PLH5C23A |
| EPA CompTox | DTXSID30184524 |
| InChI Key | VEYNISLTHXQSGU-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C14H18O6 |
| Molecular Weight | 282.11 |
| AlogP | 1.85 |
| Hydrogen Bond Acceptor | 6.0 |
| Number of Rotational Bond | 7.0 |
| Polar Surface Area | 71.06 |
| Heavy Atoms | 20.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 3044-56-2 |
| NORMAN SUSDAT | |
| FDA SRS | U3PLH5C23A |
| PubChem | 76443 |
| ChemSpider | 68915.0 |