| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | 01O524K3H4 |
| EPA CompTox | DTXSID6059368 |
Structure
| InChI Key | QJENVPXXRBETHA-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C18H36O3 |
| Molecular Weight | 300.27 |
| AlogP | 5.27 |
| Hydrogen Bond Acceptor | 3.0 |
| Number of Rotational Bond | 16.0 |
| Polar Surface Area | 35.53 |
| Heavy Atoms | 21.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 109-37-5 |
| NORMAN SUSDAT | |
| FDA SRS | 01O524K3H4 |
| PubChem | 66958 |
| ChemSpider | 60317.0 |
CONTENTS
