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    Technical details about Cioteronel, learn more about the structure, uses, toxicity, action, side effects and more

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    Cioteronel

    APIs // Active Pharmaceutical Ingredients

    PharmaCompass

    Biophore is a research-driven global pharmaceutical company focused on niche APIs for the generic industry.

    Athena Pharmaceutiques is a Partner of Choice for Drug Delivery & Life Cycle Management.

    2D Structure
    1. Also known as: Cyoctol, Exandron, 89672-11-7, X-andron, Cpc-10997, 105635-64-1
    Molecular Formula
    C16H28O2
    Molecular Weight
    252.39  g/mol
    InChI Key
    KDULJHFMZBRAHO-UHFFFAOYSA-N
    FDA UNII
    1RTH95874Z
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    4-(5-methoxyheptyl)-3,3a,4,5,6,6a-hexahydro-1H-pentalen-2-one
    2.1.2 InChI
    InChI=1S/C16H28O2/c1-3-15(18-2)7-5-4-6-12-8-9-13-10-14(17)11-16(12)13/h12-13,15-16H,3-11H2,1-2H3
    2.1.3 InChI Key
    KDULJHFMZBRAHO-UHFFFAOYSA-N
    2.1.4 Canonical SMILES
    CCC(CCCCC1CCC2C1CC(=O)C2)OC
    2.2 Other Identifiers
    2.2.1 UNII
    1RTH95874Z
    2.3 Synonyms
    2.3.1 MeSH Synonyms

    1. 6-(5-methoxy-1-heptyl)bicyclo(3,3,0)octan-3-one

    2. Cpc 10997

    3. Cpc-10997

    4. Cpc10997

    5. Cyoctol

    2.3.2 Depositor-Supplied Synonyms

    1. Cyoctol

    2. Exandron

    3. 89672-11-7

    4. X-andron

    5. Cpc-10997

    6. 105635-64-1

    7. Ethoxyheptyl Bicyclooctanone

    8. 4-(5-methoxyheptyl)-3,3a,4,5,6,6a-hexahydro-1h-pentalen-2-one

    9. Cyoctol; Exandron; X-andron

    10. 1rth95874z

    11. 6-(5-methoxy-1-heptyl)bicyclo(3,3,0)octan-3-one

    12. Cpc 10997

    13. 2(1h)-pentalenone, Hexahydro-4-(5-methoxyheptyl)-

    14. Cioteronelum

    15. 1,5-cis-verknupften

    16. Cioteronel [usan:inn]

    17. Cioteronelum [inn-latin]

    18. Unii-1rth95874z

    19. Nsc660677

    20. Nsc660678

    21. Nsc660679

    22. Nsc660680

    23. Nsc660681

    24. Nsc660682

    25. Nsc660683

    26. Cioteronel [mi]

    27. Cioteronel [inn]

    28. Cioteronel (usan/inn)

    29. Cioteronel [usan]

    30. 4-(5-methoxyheptyl)hexahydro-2(1h)-pentalenone

    31. Schembl666571

    32. (+-)-hexahydro-4-(5-methoxyheptyl)-2(1h)-pentalenone

    33. Chembl2104105

    34. Dtxsid50869028

    35. Chebi:135030

    36. Ethoxyheptyl Bicyclooctanone [inci]

    37. D03515

    38. Hexahydro-4-(5-methoxyheptyl)-2(1h)-pentalenone

    39. 2-(5-methoxyhept-1-y)bicyclo[3.3.0]octan-7-one

    40. 2-(5-methoxyhept-1-yl)-bicyclo[3.3.0]octan7-one

    41. 2-(5-methoxyhept-1-yl)bicyclo[3.3.0]octan-7-one

    42. 2-(5-methoxyhept-1-yl)bicyclo [3.3.0]octan-7-one

    43. Q15633980

    44. (+/-)-hexahydro-4-(5-methoxyheptyl)-2(1h)-pentalenone

    2.4 Create Date
    2005-08-01
    3 Chemical and Physical Properties
    Molecular Weight 252.39 g/mol
    Molecular Formula C16H28O2
    XLogP33.9
    Hydrogen Bond Donor Count0
    Hydrogen Bond Acceptor Count2
    Rotatable Bond Count7
    Exact Mass252.208930132 g/mol
    Monoisotopic Mass252.208930132 g/mol
    Topological Polar Surface Area26.3 Ų
    Heavy Atom Count18
    Formal Charge0
    Complexity274
    Isotope Atom Count0
    Defined Atom Stereocenter Count0
    Undefined Atom Stereocenter Count4
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count1
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