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    Emideltide

    ACTIVE PHARMA INGREDIENTS

    PharmaCompass
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    2D Structure
    Also known as: 62568-57-4, Dsip, Delta sleep inducing peptide, Trp-ala-gly-gly-asp-ala-ser-gly-glu, Delta sleep-inducing peptide, Dsip nonapeptide
    Molecular Formula
    C35H48N10O15
    Molecular Weight
    848.8  g/mol
    InChI Key
    ZRZROXNBKJAOKB-GFVHOAGBSA-N
    A nonapeptide that is found in neurons, peripheral organs, and plasma. This neuropeptide induces mainly delta sleep in mammals. In addition to sleep, the peptide has been observed to affect electrophysiological activity, neurotransmitter levels in the brain, circadian and locomotor patterns, hormonal levels, psychological performance, and the activity of neuropharmacological drugs including their withdrawal.
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    (2S)-2-[[2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[2-[[2-[[(2S)-2-[[(2S)-2-amino-3-(1H-indol-3-yl)propanoyl]amino]propanoyl]amino]acetyl]amino]acetyl]amino]-3-carboxypropanoyl]amino]propanoyl]amino]-3-hydroxypropanoyl]amino]acetyl]amino]pentanedioic acid
    2.1.2 InChI
    InChI=1S/C35H48N10O15/c1-16(41-32(56)20(36)9-18-11-37-21-6-4-3-5-19(18)21)30(54)39-12-25(47)38-13-26(48)44-23(10-29(52)53)34(58)42-17(2)31(55)45-24(15-46)33(57)40-14-27(49)43-22(35(59)60)7-8-28(50)51/h3-6,11,16-17,20,22-24,37,46H,7-10,12-15,36H2,1-2H3,(H,38,47)(H,39,54)(H,40,57)(H,41,56)(H,42,58)(H,43,49)(H,44,48)(H,45,55)(H,50,51)(H,52,53)(H,59,60)/t16-,17-,20-,22-,23-,24-/m0/s1
    2.1.3 InChI Key
    ZRZROXNBKJAOKB-GFVHOAGBSA-N
    2.1.4 Canonical SMILES
    CC(C(=O)NCC(=O)NCC(=O)NC(CC(=O)O)C(=O)NC(C)C(=O)NC(CO)C(=O)NCC(=O)NC(CCC(=O)O)C(=O)O)NC(=O)C(CC1=CNC2=CC=CC=C21)N
    2.1.5 Isomeric SMILES
    C[C@@H](C(=O)NCC(=O)NCC(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](CCC(=O)O)C(=O)O)NC(=O)[C@H](CC1=CNC2=CC=CC=C21)N
    2.2 Synonyms
    2.2.1 MeSH Synonyms

    1. Delta Sleep Inducing Peptide

    2. Delta Sleep Peptide

    3. Delta Sleep-inducing Peptide

    4. Delta-sleep Peptide

    5. Delta-sleep-inducing Peptide

    6. Delta-sleep-inducing-peptide

    7. Dsip

    8. Peptide, Delta Sleep-inducing

    9. Peptide, Delta-sleep

    10. Peptide, Delta-sleep-inducing

    11. Sleep-inducing Peptide, Delta

    12. Trp Ala Gly Gly Asp Ala Ser Gly Glu

    13. Trp-ala-gly-gly-asp-ala-ser-gly-glu

    2.2.2 Depositor-Supplied Synonyms

    1. 62568-57-4

    2. Dsip

    3. Delta Sleep Inducing Peptide

    4. Trp-ala-gly-gly-asp-ala-ser-gly-glu

    5. Delta Sleep-inducing Peptide

    6. Dsip Nonapeptide

    7. Emideltide [inn]

    8. L-tryptophyl-l-alanylglycylglycyl-l-aspartyl-l-alanyl-l-serylglycyl-l-glutamic Acid

    9. Delta Sleep-inducing Peptide (rabbit)

    10. Unii-yn28z5yz73

    11. Delta-sleep Inducing Peptide

    12. O-sleep Inducing Peptide

    13. Deltasleep-inducing Peptide

    14. L-glutamic Acid, L-tryptophyl-l-alanylglycylglycyl-l-alpha-aspartyl-l-alanyl-l-serylglycyl-

    15. 69431-45-4

    16. L-glutamic Acid, N-(n-(n-(n-(n-(n-(n-(n-l-tryptophyl-l-alanyl)glycyl)glycyl)-l-alpha-aspartyl)-l-alanyl)-l-seryl)-glycyl)-

    17. Schembl5523017

    18. Yn28z5yz73

    19. Chembl2104403

    20. Dtxsid20978151

    21. Glxc-25919

    22. Hy-p1501

    23. Zinc169292552

    24. L-tryptophyl-l-alanylglycylglycyl-l-alpha-aspartyl-l-alanyl-l-serylglycyl-l-glutamic Acid

    25. Cs-0044577

    26. H-trp-ala-gly-gly-asp-ala-ser-gly-glu-oh

    27. Delta-sleep Inducing Peptide Trifluoroacetate Salt

    28. Q27294600

    29. L-tryptophyl-l-alanyl-glycyl-glycyl-l-alpha-aspartyl-l-alanyl-l-seryl-glycyl-l-glutamic Acid

    30. (2s)-2-[[2-[[(2s)-2-[[(2s)-2-[[(2s)-2-[[2-[[2-[[(2s)-2-[[(2s)-2-amino-3-(1h-indol-3-yl)propanoyl]amino]propanoyl]amino]acetyl]amino]acetyl]amino]-3-carboxypropanoyl]amino]propanoyl]amino]-3-hydroxypropanoyl]amino]acetyl]amino]pentanedioic Acid

    31. (3s,9s,12s,15s)-15-(2-(2-((s)-2-((s)-2-amino-3-(1h-indol-3-yl)propanamido)propanamido)acetamido)acetamido)-9-(hydroxymethyl)-12-methyl-5,8,11,14-tetraoxo-4,7,10,13-tetraazahexadecane-1,3,16-tricarboxylic Acid

    32. N-[23-amino-11-(carboxymethyl)-1,4,7,10,13,16,19,22-octahydroxy-5-(hydroxymethyl)-24-(1h-indol-3-yl)-8,20-dimethyl-3,6,9,12,15,18,21-heptaazatetracosa-3,6,9,12,15,18,21-heptaen-1-ylidene]glutamic Acid

    2.3 Create Date
    2005-08-08
    3 Chemical and Physical Properties
    Molecular Weight 848.8 g/mol
    Molecular Formula C35H48N10O15
    XLogP3-7.1
    Hydrogen Bond Donor Count14
    Hydrogen Bond Acceptor Count16
    Rotatable Bond Count25
    Exact Mass848.33006086 g/mol
    Monoisotopic Mass848.33006086 g/mol
    Topological Polar Surface Area407 Ų
    Heavy Atom Count60
    Formal Charge0
    Complexity1610
    Isotope Atom Count0
    Defined Atom Stereocenter Count6
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count1
    4 Pharmacology and Biochemistry
    4.1 MeSH Pharmacological Classification

    Neurotransmitter Agents

    Substances used for their pharmacological actions on any aspect of neurotransmitter systems. Neurotransmitter agents include agonists, antagonists, degradation inhibitors, uptake inhibitors, depleters, precursors, and modulators of receptor function. (See all compounds classified as Neurotransmitter Agents.)