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    Fluocortolone Pivalate

    ACTIVE PHARMA INGREDIENTS

    FINISHED DOSAGE FORMULATIONS

    MARKET PLACE

    PharmaCompass
    Xls

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    2D Structure
    Also known as: 29205-06-9, Fluocortolone 21-pivalate, Einecs 249-504-4, Unii-9j8al6k50q, 9j8al6k50q, [2-[(6s,8s,9s,10r,11s,13s,14s,16r,17s)-6-fluoro-11-hydroxy-10,13,16-trimethyl-3-oxo-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl]-2-oxoethyl] 2,2-dimethylpropanoate
    Molecular Formula
    C27H37FO5
    Molecular Weight
    460.6  g/mol
    InChI Key
    XZBJVIQXJHGUBE-HZMVJJPJSA-N
    FDA UNII
    9J8AL6K50Q
    A glucocorticoid with anti-inflammatory activity used topically for various skin disorders.
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    [2-[(6S,8S,9S,10R,11S,13S,14S,16R,17S)-6-fluoro-11-hydroxy-10,13,16-trimethyl-3-oxo-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl]-2-oxoethyl] 2,2-dimethylpropanoate
    2.1.2 InChI
    InChI=1S/C27H37FO5/c1-14-9-17-16-11-19(28)18-10-15(29)7-8-26(18,5)23(16)20(30)12-27(17,6)22(14)21(31)13-33-24(32)25(2,3)4/h7-8,10,14,16-17,19-20,22-23,30H,9,11-13H2,1-6H3/t14-,16+,17+,19+,20+,22-,23-,26+,27+/m1/s1
    2.1.3 InChI Key
    XZBJVIQXJHGUBE-HZMVJJPJSA-N
    2.1.4 Canonical SMILES
    CC1CC2C3CC(C4=CC(=O)C=CC4(C3C(CC2(C1C(=O)COC(=O)C(C)(C)C)C)O)C)F
    2.1.5 Isomeric SMILES
    C[C@@H]1C[C@H]2[C@@H]3C[C@@H](C4=CC(=O)C=C[C@@]4([C@H]3[C@H](C[C@@]2([C@H]1C(=O)COC(=O)C(C)(C)C)C)O)C)F
    2.2 Other Identifiers
    2.2.1 UNII
    9J8AL6K50Q
    2.3 Synonyms
    2.3.1 MeSH Synonyms

    1. Caproate, Fluocortolone

    2. Fluocortolone

    3. Fluocortolone Caproate

    4. Pivalate, Fluocortolone

    5. Ultralan

    2.3.2 Depositor-Supplied Synonyms

    1. 29205-06-9

    2. Fluocortolone 21-pivalate

    3. Einecs 249-504-4

    4. Unii-9j8al6k50q

    5. 9j8al6k50q

    6. [2-[(6s,8s,9s,10r,11s,13s,14s,16r,17s)-6-fluoro-11-hydroxy-10,13,16-trimethyl-3-oxo-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl]-2-oxoethyl] 2,2-dimethylpropanoate

    7. 6alpha-fluoro-11beta,21-dihydroxy-16alpha-methylpregna-1,4-diene-3,20-dione 21-pivalate

    8. Ultradil (tn)

    9. Fluocortolone Trimethylacetate

    10. Schembl5675315

    11. Dtxsid30951798

    12. Chebi:177427

    13. Fluocortolone Pivalate Assay Standard

    14. Fluocortolone Pivalate [mart.]

    15. Fluocortolone Pivalate [who-dd]

    16. Fluocortolone Pivalate [ep Monograph]

    17. Fluocortolone Pivalate For Id And Assay Crs

    18. D07973

    19. Q27272623

    20. 6-fluoro-11-hydroxy-16-methyl-3,20-dioxopregna-1,4-dien-21-yl 2,2-dimethylpropanoate

    21. [2-[(6s,8s,9s,10r,11s,13s,14s,16r,17s)-6-luoro-11-hydroxy-10,13,16-trimethyl-3-oxo-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl]-2-oxoethyl] 2,2-dimethylpropanoate

    22. 6.alpha.-fluoro-11.beta.-hydroxy-16.alpha.-methyl-3,20-dioxopregna-1,4-dien-21-yl 2,2-dimethylpropanoate

    2.3.3 Other Synonyms

    1. Pivalate, Fluocortolone

    2.4 Create Date
    2005-08-08
    3 Chemical and Physical Properties
    Molecular Weight 460.6 g/mol
    Molecular Formula C27H37FO5
    XLogP34.4
    Hydrogen Bond Donor Count1
    Hydrogen Bond Acceptor Count6
    Rotatable Bond Count5
    Exact Mass g/mol
    Monoisotopic Mass g/mol
    Topological Polar Surface Area80.7
    Heavy Atom Count33
    Formal Charge0
    Complexity929
    Isotope Atom Count0
    Defined Atom Stereocenter Count9
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count1
    4 Pharmacology and Biochemistry
    4.1 MeSH Pharmacological Classification

    Glucocorticoids

    A group of CORTICOSTEROIDS that affect carbohydrate metabolism (GLUCONEOGENESIS, liver glycogen deposition, elevation of BLOOD SUGAR), inhibit ADRENOCORTICOTROPIC HORMONE secretion, and possess pronounced anti-inflammatory activity. They also play a role in fat and protein metabolism, maintenance of arterial blood pressure, alteration of the connective tissue response to injury, reduction in the number of circulating lymphocytes, and functioning of the central nervous system. (See all compounds classified as Glucocorticoids.)

    Anti-Inflammatory Agents

    Substances that reduce or suppress INFLAMMATION. (See all compounds classified as Anti-Inflammatory Agents.)