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Fezagepras (sodium) (Standard)

CAT: 0804-HY-100775R-01Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0804-HY-100775R-01Size:5 mg
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Description
Fezagepras (sodium) (Standard) is the analytical standard of Fezagepras (sodium) . This product is intended for research and analytical applications. Fezagepras (Setogepram) sodium acts as an orally active agonist for GPR40 and as an antagonist or inverse agonist for GPR84[1]. Fezagepras sodium decreases renal, liver and pancreatic fibrosis[1][2]. Fezagepras sodium exerts anti-fibrotic, anti-inflammatory and anti-proliferative actions[2].
CAS Number
1254472-97-3
Product Name Alternative
Setogepram (sodium) (Standard) ; PBI-4050 (sodium) (Standard)
UNSPSC
12352005
Target
Free Fatty Acid Receptor; GPR84; Reference Standards
Related Pathways
GPCR/G Protein; Others
Field of Research
Metabolic Disease; Inflammation/Immunology
Smiles
O=C(O[Na])CC1=CC(CCCCC)=CC=C1
Molecular Formula
C13H17NaO2
Molecular Weight
228.26
References & Citations
[1]Li Y, et al. Fatty acid receptor modulator PBI-4050 inhibits kidney fibrosis and improves glycemic control. JCI Insight. 2018 May 17;3 (10) . pii: 120365.|[2]Grouix B, et al. PBI-4050 Reduces Stellate Cell Activation and Liver Fibrosis through Modulation of Intracellular ATP Levels and the Liver Kinase B1/AMP-Activated Protein Kinase/Mammalian Target of Rapamycin Pathway. J Pharmacol Exp Ther. 2018 Oct;367 (1) :71-81.
Shipping Conditions
Room temperature
Scientific Category
Reference Standards

Chemical Information

Setogepram sodium
CAS Number1254472-97-3
PubChem CID46944243
IUPAC Namesodium 2-(3-pentylphenyl)acetate
Molecular FormulaC13H17NaO2
Molecular Weight228.26
Topological Polar Surface Area40.1
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count6
Heavy Atom Count16
Formal Charge0
Complexity194
SMILES
CCCCCC1=CC(=CC=C1)CC(=O)[O-].[Na+]
InChI
InChI=1S/C13H18O2.Na/c1-2-3-4-6-11-7-5-8-12(9-11)10-13(14)15;/h5,7-9H,2-4,6,10H2,1H3,(H,14,15);/q;+1/p-1
InChIKey
CNSJWSLXKSJQFE-UHFFFAOYSA-M
Chemical Structure
2D Structure
2D structure of Setogepram sodium
CAS: 1254472-97-3
CID: 46944243
Formula: C13H17NaO2
MW: 228.26
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight228.26
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count6
Exact Mass228.11262406
Monoisotopic Mass228.11262406
Topological Polar Surface Area40.1 Ų
Heavy Atom Count16
Formal Charge0
Complexity194
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes

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