| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | GA658J1T1N |
Structure
| InChI Key | ZESKRVSPQJVIMH-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C5H12O3 |
| Molecular Weight | 120.08 |
| AlogP | -0.36 |
| Hydrogen Bond Acceptor | 3.0 |
| Hydrogen Bond Donor | 1.0 |
| Number of Rotational Bond | 4.0 |
| Polar Surface Area | 38.69 |
| Heavy Atoms | 8.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 63784-90-7 |
| NORMAN SUSDAT | |
| FDA SRS | GA658J1T1N |
CONTENTS
