| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| EPA CompTox | DTXSID701001232 |
Structure
| InChI Key | BDSHDAZYGZUZQM-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C9H10NO7S |
| Molecular Weight | 275.01 |
| AlogP | 0.72 |
| Hydrogen Bond Acceptor | 7.0 |
| Number of Rotational Bond | 4.0 |
| Polar Surface Area | 112.81 |
| Heavy Atoms | 18.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 80430-23-5 |
| NORMAN SUSDAT | |
| PubChem | 3018937 |
CONTENTS
