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    Technical details about 1-Palmitoyl-2-Oleoyl-Sn-Glycero-3-Phosphocholine, learn more about the structure, uses, toxicity, action, side effects and more

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    1-Palmitoyl-2-Oleoyl-Sn-Glycero-3-Phosphocholine

    APIs // Active Pharmaceutical Ingredients

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    Phyton is a World Leader in Plant Cell Fermentation Technology and Commercial Manufacturing.

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    2D Structure
    1. Also known as: Schembl1649042, Q27464513
    Molecular Formula
    C42H82NO8P
    Molecular Weight
    760.1  g/mol
    InChI Key
    WTJKGGKOPKCXLL-PFDVCBLKSA-N
    (2-{[(2S)-3-(hexadecanoyloxy)-2-[(9Z)-octadec-9-enoyloxy]propyl phosphonato]oxy}ethyl)trimethylazanium is a natural product found in Dioscorea oppositifolia with data available.
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    [(2S)-3-hexadecanoyloxy-2-[(Z)-octadec-9-enoyl]oxypropyl] 2-(trimethylazaniumyl)ethyl phosphate
    2.1.2 InChI
    InChI=1S/C42H82NO8P/c1-6-8-10-12-14-16-18-20-21-23-25-27-29-31-33-35-42(45)51-40(39-50-52(46,47)49-37-36-43(3,4)5)38-48-41(44)34-32-30-28-26-24-22-19-17-15-13-11-9-7-2/h20-21,40H,6-19,22-39H2,1-5H3/b21-20-/t40-/m0/s1
    2.1.3 InChI Key
    WTJKGGKOPKCXLL-PFDVCBLKSA-N
    2.1.4 Canonical SMILES
    CCCCCCCCCCCCCCCC(=O)OCC(COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCCC=CCCCCCCCC
    2.1.5 Isomeric SMILES
    CCCCCCCCCCCCCCCC(=O)OC[C@@H](COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCC/C=C\CCCCCCCC
    2.2 Synonyms
    2.2.1 Depositor-Supplied Synonyms

    1. Schembl1649042

    2. Q27464513

    2.3 Create Date
    2006-10-26
    3 Chemical and Physical Properties
    Molecular Weight 760.1 g/mol
    Molecular Formula C42H82NO8P
    XLogP313.6
    Hydrogen Bond Donor Count0
    Hydrogen Bond Acceptor Count8
    Rotatable Bond Count41
    Exact Mass759.57780557 g/mol
    Monoisotopic Mass759.57780557 g/mol
    Topological Polar Surface Area111 Ų
    Heavy Atom Count52
    Formal Charge0
    Complexity899
    Isotope Atom Count0
    Defined Atom Stereocenter Count1
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count1
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count1
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