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    Technical details about Alpha-Onocerin, learn more about the structure, uses, toxicity, action, side effects and more

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    Alpha-Onocerin

    REF. STANDARDS & IMPURITIES

    PharmaCompass

    Farmhispania Group, a leading European CDMO in HPAPI Technologies & High Potency Fermentation.

    One Pharma aims to be one of the leading generic companies in Europe.

    2D Structure
    1. Also known as: Dtxsid10965373, Akos032948455, 5,5'-(ethane-1,2-diyl)bis(1,1,4a-trimethyl-6-methylidenedecahydronaphthalen-2-ol)
    Molecular Formula
    C30H50O2
    Molecular Weight
    442.7  g/mol
    InChI Key
    GESZMTVZGWZBPW-UHFFFAOYSA-N
    5-[2-(6-hydroxy-5,5,8a-trimethyl-2-methylidene-hexahydro-1H-naphthalen-1-yl)ethyl]-1,1,4a-trimethyl-6-methylidene-hexahydro-2H-naphthalen-2-ol is a natural product found in Ononis arvensis, Lycopodium clavatum, and other organisms with data available.
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    5-[2-(6-hydroxy-5,5,8a-trimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl)ethyl]-1,1,4a-trimethyl-6-methylidene-3,4,5,7,8,8a-hexahydro-2H-naphthalen-2-ol
    2.1.2 InChI
    InChI=1S/C30H50O2/c1-19-9-13-23-27(3,4)25(31)15-17-29(23,7)21(19)11-12-22-20(2)10-14-24-28(5,6)26(32)16-18-30(22,24)8/h21-26,31-32H,1-2,9-18H2,3-8H3
    2.1.3 InChI Key
    GESZMTVZGWZBPW-UHFFFAOYSA-N
    2.1.4 Canonical SMILES
    CC1(C2CCC(=C)C(C2(CCC1O)C)CCC3C(=C)CCC4C3(CCC(C4(C)C)O)C)C
    2.2 Synonyms
    2.2.1 Depositor-Supplied Synonyms

    1. Dtxsid10965373

    2. Akos032948455

    3. 5,5'-(ethane-1,2-diyl)bis(1,1,4a-trimethyl-6-methylidenedecahydronaphthalen-2-ol)

    2.3 Create Date
    2006-01-18
    3 Chemical and Physical Properties
    Molecular Weight 442.7 g/mol
    Molecular Formula C30H50O2
    XLogP37.4
    Hydrogen Bond Donor Count2
    Hydrogen Bond Acceptor Count2
    Rotatable Bond Count3
    Exact Mass442.381080833 g/mol
    Monoisotopic Mass442.381080833 g/mol
    Topological Polar Surface Area40.5 Ų
    Heavy Atom Count32
    Formal Charge0
    Complexity699
    Isotope Atom Count0
    Defined Atom Stereocenter Count0
    Undefined Atom Stereocenter Count8
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count1
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