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    Chemistry

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    Also known as: 80382-23-6, Loxoprofen sodium salt, Sodium 2-(4-((2-oxocyclopentyl)methyl)phenyl)propanoate, Cs-600, Loxoprofen (sodium), Sodium loxoprofen
    Molecular Formula
    C15H17NaO3
    Molecular Weight
    268.28  g/mol
    InChI Key
    WORCCYVLMMTGFR-UHFFFAOYSA-M
    FDA UNII
    NDC2M7399S
    CAS 80382-23-6
    1 2D Structure

    CAS 80382-23-6

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    sodium;2-[4-[(2-oxocyclopentyl)methyl]phenyl]propanoate
    2.1.2 InChI
    InChI=1S/C15H18O3.Na/c1-10(15(17)18)12-7-5-11(6-8-12)9-13-3-2-4-14(13)16;/h5-8,10,13H,2-4,9H2,1H3,(H,17,18);/q;+1/p-1
    2.1.3 InChI Key
    WORCCYVLMMTGFR-UHFFFAOYSA-M
    2.1.4 Canonical SMILES
    CC(C1=CC=C(C=C1)CC2CCCC2=O)C(=O)[O-].[Na+]
    2.2 Other Identifiers
    2.2.1 UNII
    NDC2M7399S
    2.3 Synonyms
    2.3.1 MeSH Synonyms

    1. 156-s

    2. 2-(4-((2-oxocyclopentyl)methyl)phenyl)propionic Acid

    3. 2-ocppp

    4. Cs 600

    5. Cs-600

    6. Loxoprofen

    7. Loxoprofen Alcohol

    8. Loxoprofen Sodium Dihydrate

    9. Loxoprofen Sodium, (r*,s*)-isomer

    10. Sodium 2-(4-(2-oxocyclopentylmethyl)phenyl)propionate Dihydrate

    11. Sodium Loxoprofen

    2.3.2 Depositor-Supplied Synonyms

    1. 80382-23-6

    2. Loxoprofen Sodium Salt

    3. Sodium 2-(4-((2-oxocyclopentyl)methyl)phenyl)propanoate

    4. Cs-600

    5. Loxoprofen (sodium)

    6. Sodium Loxoprofen

    7. Lx-a

    8. Sodium;2-[4-[(2-oxocyclopentyl)methyl]phenyl]propanoate

    9. Loxoprofen Sodium Hydrate

    10. Ndc2m7399s

    11. Chebi:76198

    12. Mfcd00941425

    13. Chembl66552

    14. Sodium 2-(4-(2-oxocyclopentylmethyl)phenyl)propionate Dihydrate

    15. Alpha-methyl-4-((2-oxocyclopentyl)methyl)benzeneacetate Sodium Salt Dihydrate

    16. Sodium 2-{4-[(2-oxocyclopentyl)methyl]phenyl}propanoate

    17. Unii-ndc2m7399s

    18. Lp-x

    19. Mls001401445

    20. Schembl383675

    21. Sodium 2-[4-[(2-oxocyclopentyl)methyl]phenyl]propionate

    22. Hy-b0578a

    23. Amy8901

    24. Cs-600g

    25. Hms2051d12

    26. Hms2233j14

    27. Hms3370c11

    28. Hms3393d12

    29. Loxoprofen Sodium [who-dd]

    30. Loxoprofen Sodium Salt [mi]

    31. Akos025392177

    32. Ccg-101024

    33. Ccg-267132

    34. Ks-5040

    35. Loxoprofen Sodium Hydrate [jan]

    36. Nc00274

    37. Bl164648

    38. Smr000469165

    39. Cs-0013894

    40. Ft-0630879

    41. L0252

    42. A839900

    43. Q-201325

    44. Q27145804

    45. Sodium2-(4-((2-oxocyclopentyl)methyl)phenyl)propanoate

    46. 2-{4-[(2-oxocyclopentyl)methyl]phenyl}propanoate Sodium Salt

    47. 2-[4-[(2-oxocyclopentyl)methyl]phenyl]propionic Acid Sodium Salt

    48. Sodium 2-(4-((2-oxocyclopentyl)methyl)(phenyl)propionate

    49. Benzeneacetic Acid, Alpha-methyl-4-((2-oxocyclopentyl)methyl)-, Sodium Salt, Dihydrate

    50. Benzeneacetic Acid, .alpha.-methyl-4-((2-oxocyclopentyl)methyl)-, Sodium Salt (1:1)

    2.4 Create Date
    2008-02-05
    3 Chemical and Physical Properties
    Molecular Weight 268.28 g/mol
    Molecular Formula C15H17NaO3
    Hydrogen Bond Donor Count0
    Hydrogen Bond Acceptor Count3
    Rotatable Bond Count4
    Exact Mass268.10753868 g/mol
    Monoisotopic Mass268.10753868 g/mol
    Topological Polar Surface Area57.2 Ų
    Heavy Atom Count19
    Formal Charge0
    Complexity321
    Isotope Atom Count0
    Defined Atom Stereocenter Count0
    Undefined Atom Stereocenter Count2
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count2
    4 Pharmacology and Biochemistry
    4.1 MeSH Pharmacological Classification

    Anti-Inflammatory Agents, Non-Steroidal

    Anti-inflammatory agents that are non-steroidal in nature. In addition to anti-inflammatory actions, they have analgesic, antipyretic, and platelet-inhibitory actions. They act by blocking the synthesis of prostaglandins by inhibiting cyclooxygenase, which converts arachidonic acid to cyclic endoperoxides, precursors of prostaglandins. Inhibition of prostaglandin synthesis accounts for their analgesic, antipyretic, and platelet-inhibitory actions; other mechanisms may contribute to their anti-inflammatory effects. (See all compounds classified as Anti-Inflammatory Agents, Non-Steroidal.)

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