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    Zovaglutide modified lysine

    DEVELOPMENTS

    PharmaCompass
    Xls

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    2D Structure
    Also known as: Wy4jv5k93d, (22s)-22,40-dicarboxy-10,19,24-trioxo-3,6,12,15-tetraoxa-9,18,23-triazatetracontan-1-oyl lysine
    Molecular Formula
    C42H77N5O13
    Molecular Weight
    860.1  g/mol
    InChI Key
    TWYJHRVWSCUQAQ-ZPGRZCPFSA-N
    FDA UNII
    WY4JV5K93D
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    18-[[(3S)-6-[2-[2-[2-[2-[2-[2-[[(5S)-5-amino-5-carboxypentyl]amino]-2-oxoethoxy]ethoxy]ethylamino]-2-oxoethoxy]ethoxy]ethylamino]-2,6-dioxohexan-3-yl]amino]-18-oxooctadecanoic acid
    2.1.2 InChI
    InChI=1S/C42H77N5O13/c1-34(48)36(47-38(50)19-14-12-10-8-6-4-2-3-5-7-9-11-13-15-20-41(53)54)21-22-37(49)45-24-26-57-28-31-60-33-40(52)46-25-27-58-29-30-59-32-39(51)44-23-17-16-18-35(43)42(55)56/h35-36H,2-33,43H2,1H3,(H,44,51)(H,45,49)(H,46,52)(H,47,50)(H,53,54)(H,55,56)/t35-,36-/m0/s1
    2.1.3 InChI Key
    TWYJHRVWSCUQAQ-ZPGRZCPFSA-N
    2.2 Other Identifiers
    2.2.1 UNII
    WY4JV5K93D
    2.3 Synonyms
    2.3.1 Depositor-Supplied Synonyms

    1. Wy4jv5k93d

    2. (22s)-22,40-dicarboxy-10,19,24-trioxo-3,6,12,15-tetraoxa-9,18,23-triazatetracontan-1-oyl Lysine

    2.4 Create Date
    2025-03-11
    3 Chemical and Physical Properties
    Molecular Weight 860.1 g/mol
    Molecular Formula C42H77N5O13
    XLogP31.2
    Hydrogen Bond Donor Count7
    Hydrogen Bond Acceptor Count14
    Rotatable Bond Count44
    Exact Mass Da
    Monoisotopic Mass Da
    Topological Polar Surface Area271
    Heavy Atom Count60
    Formal Charge0
    Complexity1180
    Isotope Atom Count0
    Defined Atom Stereocenter Count2
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count1
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