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    Chemistry

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    Also known as: 4042-36-8, 5-oxo-d-proline, (r)-5-oxopyrrolidine-2-carboxylic acid, D-pyr-oh, (2r)-5-oxopyrrolidine-2-carboxylic acid, D-proline, 5-oxo-
    Molecular Formula
    C5H7NO3
    Molecular Weight
    129.11  g/mol
    InChI Key
    ODHCTXKNWHHXJC-GSVOUGTGSA-N
    FDA UNII
    TQP297C4HN
    D-Pyroglutamic Acid
    5-oxo-D-proline is a natural product found in Ascochyta medicaginicola and Rehmannia glutinosa with data available.
    1 2D Structure

    D-Pyroglutamic Acid

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    (2R)-5-oxopyrrolidine-2-carboxylic acid
    2.1.2 InChI
    InChI=1S/C5H7NO3/c7-4-2-1-3(6-4)5(8)9/h3H,1-2H2,(H,6,7)(H,8,9)/t3-/m1/s1
    2.1.3 InChI Key
    ODHCTXKNWHHXJC-GSVOUGTGSA-N
    2.1.4 Canonical SMILES
    C1CC(=O)NC1C(=O)O
    2.1.5 Isomeric SMILES
    C1CC(=O)N[C@H]1C(=O)O
    2.2 Other Identifiers
    2.2.1 UNII
    TQP297C4HN
    2.3 Synonyms
    2.3.1 Depositor-Supplied Synonyms

    1. 4042-36-8

    2. 5-oxo-d-proline

    3. (r)-5-oxopyrrolidine-2-carboxylic Acid

    4. D-pyr-oh

    5. (2r)-5-oxopyrrolidine-2-carboxylic Acid

    6. D-proline, 5-oxo-

    7. (r)-(+)-2-pyrrolidone-5-carboxylic Acid

    8. D-pidolic Acid

    9. (+)-pyroglutamic Acid

    10. D-(+)-pyroglutamic Acid

    11. D-5-oxo-2-pyrrolidinecarboxylic Acid

    12. D-5-pyrrolidone-2-carboxylic Acid

    13. Tqp297c4hn

    14. Chebi:16924

    15. (+)-2-pyrrolidone-5-carboxylic Acid

    16. Mfcd00066212

    17. (r)-()-2-pyrrolidone-5-carboxylic Acid

    18. (+)-pidolic Acid

    19. D-glutamic Acid Lactam

    20. Pyroglutaminsaure

    21. D-pyroglu

    22. D-5-oxoproline

    23. Einecs 223-735-0

    24. (r)-2-pyrrolidone-5-carboxylic Acid

    25. (r)-pyroglutamic Acid

    26. Pyroglutamic Acid, D-

    27. H-d-pyr-oh

    28. Recpga 100k

    29. Recpga 373k

    30. (+)-d-pyroglutamic Acid

    31. (r)-(+)-2-pyrrolidinone-5-carboxylic Acid

    32. Proline, 5-oxo-, D-

    33. Bmse000483

    34. Bmse000821

    35. Bmse000878

    36. Unii-tqp297c4hn

    37. L-pyroglutamic Acid-[d5]

    38. Schembl223918

    39. Chembl1235172

    40. Dtxsid10193432

    41. Act00033

    42. Bcp09505

    43. Zinc3598262

    44. S3107

    45. Akos006238827

    46. Akos015923215

    47. Cs-w002304

    48. Hy-w002304

    49. (r)-2-pyrrolidinone-5-carboxylic Acid

    50. Ncgc00163340-01

    51. Ds-13756

    52. Am20100078

    53. P1354

    54. C02237

    55. (r)-(+)-2-pyrrolidone-5-carboxylic Acid, 95%

    56. Q421383

    57. 220c30ed-a76b-4fea-a8dd-577ccebee7de

    58. Q-100462

    59. F0001-2478

    2.4 Create Date
    2004-09-16
    3 Chemical and Physical Properties
    Molecular Weight 129.11 g/mol
    Molecular Formula C5H7NO3
    XLogP3-0.8
    Hydrogen Bond Donor Count2
    Hydrogen Bond Acceptor Count3
    Rotatable Bond Count1
    Exact Mass129.042593085 g/mol
    Monoisotopic Mass129.042593085 g/mol
    Topological Polar Surface Area66.4 Ų
    Heavy Atom Count9
    Formal Charge0
    Complexity154
    Isotope Atom Count0
    Defined Atom Stereocenter Count1
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count1

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    04-Aug-2021
    07-Aug-2022
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