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    Gallium Citrate

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    2D Structure
    Also known as: 27905-02-8, Citric acid, gallium salt (1:1), Citric acid, gallium(ii) salt, Ht6c49l0zp, Gallium;2-hydroxypropane-1,2,3-tricarboxylate, 30403-03-3
    Molecular Formula
    C6H5GaO7
    Molecular Weight
    258.82  g/mol
    InChI Key
    YEEGWNXDUZONAA-UHFFFAOYSA-K
    FDA UNII
    HT6C49L0ZP
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    gallium;2-hydroxypropane-1,2,3-tricarboxylate
    2.1.2 InChI
    InChI=1S/C6H8O7.Ga/c7-3(8)1-6(13,5(11)12)2-4(9)10;/h13H,1-2H2,(H,7,8)(H,9,10)(H,11,12);/q;+3/p-3
    2.1.3 InChI Key
    YEEGWNXDUZONAA-UHFFFAOYSA-K
    2.1.4 Canonical SMILES
    C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O.[Ga+3]
    2.2 Other Identifiers
    2.2.1 UNII
    HT6C49L0ZP
    2.3 Synonyms
    2.3.1 MeSH Synonyms

    1. (68)ga-citrate

    2. Ga-67 Citrate

    3. Gallium Citrate (1:1); 67ga-labeled

    4. Gallium Citrate, 67ga-labeled

    5. Gallium(67) Citrate

    6. Gallium-67-citrate

    2.3.2 Depositor-Supplied Synonyms

    1. 27905-02-8

    2. Citric Acid, Gallium Salt (1:1)

    3. Citric Acid, Gallium(ii) Salt

    4. Ht6c49l0zp

    5. Gallium;2-hydroxypropane-1,2,3-tricarboxylate

    6. 30403-03-3

    7. Nsc-15011

    8. Einecs 248-721-1

    9. Nsc 15011

    10. Unii-ht6c49l0zp

    11. Gallium 2-hydroxypropane-1,2,3-tricarboxylate

    12. Schembl37799

    13. Gallium Citrate [mi]

    14. Dtxsid50952742

    15. 2-hydroxy-1,2,3-propanetricarboxylic Acid Gallium Salt (1:1)

    16. 1,2,3-propanetricarboxylic Acid, 2-hydroxy-, Gallium Salt

    2.4 Create Date
    2005-08-08
    3 Chemical and Physical Properties
    Molecular Weight 258.82 g/mol
    Molecular Formula C6H5GaO7
    Hydrogen Bond Donor Count1
    Hydrogen Bond Acceptor Count7
    Rotatable Bond Count2
    Exact Mass257.92910 g/mol
    Monoisotopic Mass257.92910 g/mol
    Topological Polar Surface Area141 Ų
    Heavy Atom Count14
    Formal Charge0
    Complexity211
    Isotope Atom Count0
    Defined Atom Stereocenter Count0
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count2
    4 Pharmacology and Biochemistry
    4.1 MeSH Pharmacological Classification

    Radiopharmaceuticals

    Compounds that are used in medicine as sources of radiation for radiotherapy and for diagnostic purposes. They have numerous uses in research and industry. (Martindale, The Extra Pharmacopoeia, 30th ed, p1161) (See all compounds classified as Radiopharmaceuticals.)