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    Saroglitazar

    ACTIVE PHARMA INGREDIENTS

    FINISHED DOSAGE FORMULATIONS

    DIGITAL CONTENT

    MARKET PLACE

    PharmaCompass
    $ API Ref.Price (USD/KG) : 1,673Xls

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    2D Structure
    Also known as: 495399-09-2, Lipaglyn, Zyh1, Saroglitazar [inn], (s)-2-ethoxy-3-(4-(2-(2-methyl-5-(4-(methylthio)phenyl)-1h-pyrrol-1-yl)ethoxy)phenyl)propanoic acid, E0ymx3s4jd
    Molecular Formula
    C25H29NO4S
    Molecular Weight
    439.6  g/mol
    InChI Key
    MRWFZSLZNUJVQW-DEOSSOPVSA-N
    FDA UNII
    E0YMX3S4JD
    Saroglitazar has been investigated for the treatment of Fatty Liver.
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    (2S)-2-ethoxy-3-[4-[2-[2-methyl-5-(4-methylsulfanylphenyl)pyrrol-1-yl]ethoxy]phenyl]propanoic acid
    2.1.2 InChI
    InChI=1S/C25H29NO4S/c1-4-29-24(25(27)28)17-19-6-10-21(11-7-19)30-16-15-26-18(2)5-14-23(26)20-8-12-22(31-3)13-9-20/h5-14,24H,4,15-17H2,1-3H3,(H,27,28)/t24-/m0/s1
    2.1.3 InChI Key
    MRWFZSLZNUJVQW-DEOSSOPVSA-N
    2.1.4 Canonical SMILES
    CCOC(CC1=CC=C(C=C1)OCCN2C(=CC=C2C3=CC=C(C=C3)SC)C)C(=O)O
    2.1.5 Isomeric SMILES
    CCO[C@@H](CC1=CC=C(C=C1)OCCN2C(=CC=C2C3=CC=C(C=C3)SC)C)C(=O)O
    2.2 Other Identifiers
    2.2.1 UNII
    E0YMX3S4JD
    2.3 Synonyms
    2.3.1 MeSH Synonyms

    1. (2s)-2-ethoxy-3-(4-(2-(2-methyl-5-(4-(methylsulfanyl)phenyl)-1h-pyrrol-1-yl(ethoxy)phenyl)propanoic Acid

    2. (2s)-2-ethoxy-3-(4-(2-(2-methyl-5-(4-(methylsulfanyl)phenyl)-1h-pyrrol-1-yl(ethoxy)phenyl)propanoic Acid Magnesium Salt (2:1)

    3. Alpha-ethoxy-4-(2-(2-methyl-5-(4-methylthio)phenyl))-1h-pyrrol-1-yl)ethoxy))benzenepropanoic Acid

    4. Alpha-ethoxy-4-(2-(2-methyl-5-(4-methylthio)phenyl))-1h-pyrrol-1-yl)ethoxy))benzenepropanoic Acid Magnesium Salt

    5. Lipaglyn

    6. Saroglitazar Magnesium

    7. Zyh1 Compound

    2.3.2 Depositor-Supplied Synonyms

    1. 495399-09-2

    2. Lipaglyn

    3. Zyh1

    4. Saroglitazar [inn]

    5. (s)-2-ethoxy-3-(4-(2-(2-methyl-5-(4-(methylthio)phenyl)-1h-pyrrol-1-yl)ethoxy)phenyl)propanoic Acid

    6. E0ymx3s4jd

    7. 495399-09-2 (free)

    8. (2s)-2-ethoxy-3-[4-[2-[2-methyl-5-(4-methylsulfanylphenyl)pyrrol-1-yl]ethoxy]phenyl]propanoic Acid

    9. Unii-e0ymx3s4jd

    10. Saroglitazarum

    11. Saroglitazar [who-dd]

    12. Chembl4297530

    13. Schembl16346340

    14. Dtxsid10197819

    15. Chebi:134708

    16. Bcp25470

    17. Vua39909

    18. Mfcd28502034

    19. S9674

    20. Cs-6149

    21. Db13115

    22. (2s)-2-ethoxy-3-(4-(2-(2-methyl-5-(4-(methylsulfanyl)phenyl)-1h-pyrrol-1-yl(ethoxy)phenyl)propanoic Acid

    23. Hy-19937

    24. P14958

    25. A913988

    26. Q15269693

    27. (2s)-2-ethoxy-3-[4-(2-{2-methyl-5-[4-(methylthio)phenyl]-1h-pyrrol-1-yl}ethoxy)phenyl]propanoic Acid

    28. (s)-alpha-ethoxy-4-[2-[-methyl-5-[4-(methylthio) Phenyl]-1h-pyrrol-1-yl]ethoxy]benzene-propanoic Acid

    29. Benzenepropanoic Acid, .alpha.-ethoxy-4-(2-(2-methyl-5-(4-(methylthio)phenyl)-1h-pyrrol-1-yl)ethoxy)-, (.alpha.s)-

    2.4 Create Date
    2012-09-10
    3 Chemical and Physical Properties
    Molecular Weight 439.6 g/mol
    Molecular Formula C25H29NO4S
    XLogP34.9
    Hydrogen Bond Donor Count1
    Hydrogen Bond Acceptor Count5
    Rotatable Bond Count11
    Exact Mass439.18172958 g/mol
    Monoisotopic Mass439.18172958 g/mol
    Topological Polar Surface Area86 Ų
    Heavy Atom Count31
    Formal Charge0
    Complexity532
    Isotope Atom Count0
    Defined Atom Stereocenter Count1
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count1