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    DEPC

    ACTIVE PHARMA INGREDIENTS

    PharmaCompass
    Xls

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    2D Structure
    Also known as: 51779-95-4, L-dierucoyl lecithin, Dierucoyllecithin, Depc, l-, Depc, r-, 1,2-di13-cis-docosenoyl-sn-glycero-3-phosphocholine
    Molecular Formula
    C52H100NO8P
    Molecular Weight
    898.3  g/mol
    InChI Key
    SDEURMLKLAEUAY-JFSPZUDSSA-N
    FDA UNII
    1Z951826B6
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    [(2R)-2,3-bis[[(Z)-docos-13-enoyl]oxy]propyl] 2-(trimethylazaniumyl)ethyl phosphate
    2.1.2 InChI
    InChI=1S/C52H100NO8P/c1-6-8-10-12-14-16-18-20-22-24-26-28-30-32-34-36-38-40-42-44-51(54)58-48-50(49-60-62(56,57)59-47-46-53(3,4)5)61-52(55)45-43-41-39-37-35-33-31-29-27-25-23-21-19-17-15-13-11-9-7-2/h20-23,50H,6-19,24-49H2,1-5H3/b22-20-,23-21-/t50-/m1/s1
    2.1.3 InChI Key
    SDEURMLKLAEUAY-JFSPZUDSSA-N
    2.1.4 Canonical SMILES
    CCCCCCCCC=CCCCCCCCCCCCC(=O)OCC(COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCCCCCCC=CCCCCCCCC
    2.1.5 Isomeric SMILES
    CCCCCCCC/C=C\CCCCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCCCCCC/C=C\CCCCCCCC
    2.2 Other Identifiers
    2.2.1 UNII
    1Z951826B6
    2.3 Synonyms
    2.3.1 MeSH Synonyms

    1. 1,2-didocos-13-enoyl Phoshatidylcholine

    2.3.2 Depositor-Supplied Synonyms

    1. 51779-95-4

    2. L-dierucoyl Lecithin

    3. Dierucoyllecithin

    4. Depc, L-

    5. Depc, R-

    6. 1,2-di13-cis-docosenoyl-sn-glycero-3-phosphocholine

    7. 1,2-dierucoyl-phosphatidylcholine, R-

    8. 1,2-dierucoyl-sn-glycerol-3-phosphorylcholine

    9. Pc(22:1/22:1)

    10. Dierucoyl-l-a-glycerophosphorylcholine

    11. 1,2-di-(13z-docosenoyl)-sn-glycero-3-phosphocholine

    12. Pc(22:1(13z)/22:1(13z))

    13. 1z951826b6

    14. 1,2-dierucoyl-sn-glycero-3-phosphatidylcholine

    15. [(2r)-2,3-bis[[(z)-docos-13-enoyl]oxy]propyl] 2-(trimethylazaniumyl)ethyl Phosphate

    16. 3,5,9-trioxa-4-phosphahentriacont-22-en-1-aminium, 4-hydroxy-n,n,n-trimethyl-10-oxo-7-(((13z)-1-oxo-13-docosen-1-yl)oxy)-, Inner Salt, 4-oxide, (7r,22z)-

    17. Dierucoylphosphatidylcholine

    18. 3,5,9-trioxa-4-phosphahentriacont-22-en-1-aminium, 4-hydroxy-n,n,n-trimethyl-10-oxo-7-[[(13z)-1-oxo-13-docosen-1-yl]oxy]-, Inner Salt, 4-oxide, (7r,22z)-

    19. Unii-1z951826b6

    20. Dierucoyl Phosphatidylcholine

    21. Schembl178155

    22. 22:1 (cis) Pc

    23. Dtxsid401345798

    24. Phosphatidylcholine(22:1/22:1)

    25. 76420-81-0

    26. Bca77995

    27. Gpcho(22:1/22:1)

    28. Gpcho(22:1n9/22:1n9)

    29. Gpcho(22:1w9/22:1w9)

    30. Lmgp01011110

    31. Mfcd00674315

    32. Hy-w127499

    33. Pc(22:1n9/22:1n9)

    34. Pc(22:1w9/22:1w9)

    35. Phosphatidylcholine(22:1n9/22:1n9)

    36. Phosphatidylcholine(22:1w9/22:1w9)

    37. 1,2-didocos-13-enoyl Phoshatidylcholine

    38. Bp-26302

    39. 1,2-dierucoyl-rac-glycero-3-phosphocholine

    40. Dierucoyl-l-.alpha.-glycerophosphorylcholine

    41. Cs-0185727

    42. D5319

    43. T70993

    44. Q27253299

    45. 1,2-dierucoyl-sn-glycero-3-phosphocholine, >=98.0% (tlc)

    46. 22:1 (cis) Pc, 1,2-dierucoyl-sn-glycero-3-phosphocholine, Powder

    47. (r)-2,3-bis(erucoyloxy)propyl [2-(trimethylammonio)ethyl] Phosphate

    48. 1,2-dierucoyl-sn-glycero-3-phosphocholine Pound>>1,2-di(cis-13-docosenoyl)-sn-glycero-3-phosphocholine

    49. 3,5,9-trioxa-4-phosphahentriacont-22-en-1-aminium, 4-hydroxy-n,n,n-trimethyl-10-oxo-7-((1-oxo-13-docosenyl)oxy)-, Hydroxide, Inner Salt, 4-oxide, (r)-

    50. 3,5,9-trioxa-4-phosphahentriacont-22-en-1-aminium, 4-hydroxy-n,n,n-trimethyl-10-oxo-7-[(1-oxo-13-docosenyl)oxy]-, Inner Salt, 4-oxide, [r-(z,z)]-

    51. 3,5,9-trioxa-4-phosphahentriacont-22-en-1-aminium,4-hydroxy-n,n,n-trimethyl-10-oxo-7-[[(13z)-1-oxo-13-docosen-1-yl]oxy]-,innersalt,4-oxide,(7r,22z)-

    2.3.3 Other Synonyms

    1. Depc

    2. Depc Api

    2.4 Create Date
    2008-05-14
    3 Chemical and Physical Properties
    Molecular Weight 898.3 g/mol
    Molecular Formula C52H100NO8P
    XLogP318.1
    Hydrogen Bond Donor Count0
    Hydrogen Bond Acceptor Count8
    Rotatable Bond Count50
    Exact Mass g/mol
    Monoisotopic Mass g/mol
    Topological Polar Surface Area111
    Heavy Atom Count62
    Formal Charge0
    Complexity1100
    Isotope Atom Count0
    Defined Atom Stereocenter Count1
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count2
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count1