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  • Pglu-glu-pronh2 ,Glp-glu-pronh2 ,Pglu-glu-pro-amide ,pGlu-Glu-Pro-NH2,
  • 发布时间:2004-10-25 来源:本站整理
  • [Synonyms]
    Pglu-glu-pronh2
    Glp-glu-pronh2
    Pglu-glu-pro-amide
    pGlu-Glu-Pro-NH2
    Fertilization promoting peptide
    Pyroglutamyl-glutamyl-prolinamide
    Pyroglutamyl-glutamyl-prolineamide
    pyroglutamyl-glutamyl-proline amide
    L-Prolinamide, 5-oxo-L-prolyl-L-alpha-glutamyl-
    85541-78-2

    [Structure]
    Pglu-glu-pronh2 ,Glp-glu-pronh2 ,Pglu-glu-pro-amide ,pGlu-Glu-Pro-NH2,

    [ Properties Computed from Structure]
    Molecular Weight354.35838 [g/mol]
    Molecular FormulaC15H22N4O6
    XLogP-2.5
    H-Bond Donor4
    H-Bond Acceptor6
    Rotatable Bond Count7
    Tautomer Count12
    Exact Mass354.153934
    MonoIsotopic Mass354.153934
    Topological Polar Surface Area159
    Heavy Atom Count25
    Formal Charge0
    Complexity593
    Isotope Atom Count0
    Defined Atom StereoCenter Count3
    Undefined Atom StereoCenter Count0
    Defined Bond StereoCenter Count0
    Undefined Bond StereoCenter Count0
    Covalently-Bonded Unit Count1

    [ Descriptors Computed from Structure]
    IUPAC Name: (4S)-5-[(2S)-2-carbamoylpyrrolidin-1-yl]-5-oxo-4-[[(2S)-5-
    oxopyrrolidine-2-carbonyl]amino]pentanoic acid
    Canonical SMILES: C1CC(N(C1)C(=O)C(CCC(=O)O)NC(=O)C2CCC(=O)N2)C(=O)N
    Isomeric SMILES: C1C[C@H](N(C1)C(=O)[C@H](CCC(=O)O)NC(=O)[C@@H]2CCC(=O)N2)C(=O)N
    InChI: InChI=1/C15H22N4O6/c16-13(23)10-2-1-7-19(10)15(25)9(4-6-12(21)22)18-14
    (24)8-3-5-11(20)17-8/h8-10H,1-7H2,(H2,16,23)(H,17,20)(H,18,24)(H,21,
    22)/t8-,9-,10-/m0/s1/f/h17-18,21H,16H2

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