| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | AZQ08K38Z1 |
| EPA CompTox | DTXSID90173333 |
Structure
| InChI Key | VLMWBWYAHNRUGC-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C20H32O3 |
| Molecular Weight | 320.24 |
| AlogP | 5.86 |
| Hydrogen Bond Acceptor | 3.0 |
| Hydrogen Bond Donor | 1.0 |
| Number of Rotational Bond | 13.0 |
| Polar Surface Area | 46.53 |
| Heavy Atoms | 23.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 19666-16-1 |
| NORMAN SUSDAT | |
| FDA SRS | AZQ08K38Z1 |
| PubChem | 88191 |
| ChemSpider | 79561.0 |
CONTENTS
