≥98% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
Store at -20°C Ships Ice chest + Ice pads Check lot-specific COA for exact specifications.
SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.
Cited in 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.
Information
Treprostinil sodium Treprostinil sodium (UT-15, Remodulin, Orenitram, Tyvaso, Trevyent) is a potent agonist of DP1 , EP2 and IP receptors with Ki 4.4 nM, 3.6 nM and 32 nM, respectively.
Targets
EP2 (Cell-free assay); DP1 (Cell-free assay); IP (Cell-free assay) 3.6 nM(Ki); 4.4 nM(Ki); 32 nM(Ki)
| ALogP | 4.526 |
|---|---|
| HBD Count | 2 |
| Rotatable Bond | 11 |
| Pubchem Sid | 528772032 |
|---|---|
| Canonical Smiles | CCCCCC(CCC1C(CC2C1CC3=C(C2)C(=CC=C3)OCC(=O)[O-])O)O.[Na+] |
| IUPAC Name | sodium;2-[[(1R,2R,3aS,9aS)-2-hydroxy-1-[(3S)-3-hydroxyoctyl]-2,3,3a,4,9,9a-hexahydro-1H-cyclopenta[g]naphthalen-5-yl]oxy]acetate |
| InChIKey | IQKAWAUTOKVMLE-ZSESPEEFSA-M |
| INCHI | 1S/C23H34O5.Na/c1-2-3-4-7-17(24)9-10-18-19-11-15-6-5-8-22(28-14-23(26)27)20(15)12-16(19)13-21(18)25;/h5-6,8,16-19,21,24-25H,2-4,7,9-14H2,1H3,(H,26,27);/q;+1/p-1/t16-,17-,18+,19-,21+;/m0./s1 |
| Isomeric SMILES | CCCCC[C@@H](CC[C@H]1[C@@H](C[C@H]2[C@@H]1CC3=C(C2)C(=CC=C3)OCC(=O)[O-])O)O.[Na+] |
| PubChem CID | 23663413 |
| Molecular Weight | 412.49 |
Comprehensive hazard, handling, storage, and regulatory compliance document.
Download SDS →Lot-specific quality data. Enter your lot number to retrieve the exact COA.
Look up COA →Full quality attributes and acceptance criteria for this grade.
View spec sheet →Taxonomy Tree
| Kingdom | Organic compounds |
|---|---|
| Superclass | Benzenoids |
| Class | Benzene and substituted derivatives |
| Subclass | Phenoxyacetic acid derivatives |
| Intermediate Tree Nodes | Not available |
| Direct Parent | Phenoxyacetic acid derivatives |
| Alternative Parents | Tetralins Alkyl aryl ethers Secondary alcohols Cyclic alcohols and derivatives Carboxylic acid salts Monocarboxylic acids and derivatives Carboxylic acids Organic zwitterions Organic sodium salts Organic oxides Hydrocarbon derivatives Carbonyl compounds |
| Molecular Framework | Aromatic homopolycyclic compounds |
| Substituents | Phenoxyacetate - Tetralin - Alkyl aryl ether - Cyclic alcohol - Carboxylic acid salt - Secondary alcohol - Carboxylic acid derivative - Organic alkali metal salt - Carboxylic acid - Ether - Monocarboxylic acid or derivatives - Alcohol - Organooxygen compound - Organic zwitterion - Organic salt - Organic sodium salt - Hydrocarbon derivative - Organic oxide - Carbonyl group - Organic oxygen compound - Aromatic homopolycyclic compound |
| Description | This compound belongs to the class of organic compounds known as phenoxyacetic acid derivatives. These are compounds containing an anisole where the methane group is linked to an acetic acid or a derivative. |
| External Descriptors | organic sodium salt |
Find and download the COA for your product by matching the lot number on the packaging.
| Lot Number | Certificate Type | Date | Item |
|---|---|---|---|
 G2203348 | Certificate of Analysis | Apr 07, 2025 | T412323 |
| G2203350 | Certificate of Analysis | Apr 07, 2025 | T412323 |
| G2203351 | Certificate of Analysis | Apr 07, 2025 | T412323 |
| G2203352 | Certificate of Analysis | Apr 07, 2025 | T412323 |
| G2203353 | Certificate of Analysis | Apr 07, 2025 | T412323 |
| Solubility | Solubility (25°C) In vitro DMSO: 82 mg/mL (198.79 mM); Water: 82 mg/mL (198.79 mM); Ethanol: 82 mg/mL (198.79 mM); |
|---|---|
| Sensitivity | sensitive to humidity |
| DMSO(mg / mL) Max Solubility | 82 |
| DMSO(mM) Max Solubility | 198.7926980048 |
| Water(mg / mL) Max Solubility | 82 |
| Water(mM) Max Solubility | 198.7926980048 |
| Molecular Weight | 412.500 g/mol |
| XLogP3 | |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 10 |
| Exact Mass | 412.223 Da |
| Monoisotopic Mass | 412.223 Da |
| Topological Polar Surface Area | 89.800 Ų |
| Heavy Atom Count | 29 |
| Formal Charge | 0 |
| Complexity | 502.000 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 5 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| The total count of all stereochemical bonds | 0 |
| Covalently-Bonded Unit Count | 2 |
