4-Thiaprostaglandin E1
3-[3-[(1R,2R,3R)-3-hydroxy-2-[(E)-3-hydroxyoct-1-enyl]-5-oxocyclopentyl]propylsulfanyl]propanoic acid
Also Known As: 4-Thiaprostaglandin E1|4-Thia-PGE1|3-[3-[(1R,2R,3R)-3-hydroxy-2-[(E)-3-hydroxyoct-1-enyl]-5-oxocyclopentyl]propylsulfanyl]propanoic acid|Propanoic acid, 3-((3-(3-hydroxy-2-(3-hydroxy-1-octenyl)-5-oxocyclopentyl)propyl)thio)-, (1R-(1alpha,2beta(1E,3S*),3alpha))-
CAS: 83010-28-0
| Molecular Formula | C19H32O5S |
|---|---|
| Molecular Weight | 372.19705 g/mol |
| LogP | 3.038 |
| Topological Polar Surface Area | 94.83 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 13 |
| Exact Mass | 372.19705 |
| Monoisotopic Mass | 372.19705 |
| Heavy Atoms | 25 |
| Complexity | 437.5304 |
Chemical Identifiers
| CAS Number | 83010-28-0 |
|---|---|
| SMILES | CCCCCC(/C=C/[C@H]1[C@@H](CC(=O)[C@@H]1CCCSCCC(=O)O)O)O |
Product Overview
4-Thiaprostaglandin E1 (CAS 83010-28-0), with molecular formula C19H32O5S and molecular weight 372.19705 g/mol. IUPAC: 3-[3-[(1R,2R,3R)-3-hydroxy-2-[(E)-3-hydroxyoct-1-enyl]-5-oxocyclopentyl]propylsulfanyl]propanoic acid.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
View MSDS →
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