| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| UNII | T57U4J4K5F |
| EPA CompTox | DTXSID20196414 |
Structure
| InChI Key | QOCXHIDKNIMUKQ-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C9H16O6SSi |
| Molecular Weight | 280.04 |
| AlogP | 0.93 |
| Hydrogen Bond Acceptor | 7.0 |
| Hydrogen Bond Donor | 1.0 |
| Number of Rotational Bond | 6.0 |
| Polar Surface Area | 78.9 |
| Heavy Atoms | 17.0 |
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 45189-99-9 |
| NORMAN SUSDAT | |
| FDA SRS | T57U4J4K5F |
| PubChem | 3016442 |
CONTENTS
