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    UNII-I670EI8M2N

    ACTIVE PHARMA INGREDIENTS

    PharmaCompass
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    2D Structure
    Also known as: Tasto, 13755-41-4, I670ei8m2n, Tris(hydroxymethyl)aminomethanegluconate dihydroxyaluminate, Aluminum;2-amino-2-(hydroxymethyl)propane-1,3-diol;(2r,3s,4r,5r)-2,3,4,5,6-pentahydroxyhexanoate;dihydroxide, Unii-i670ei8m2n
    Molecular Formula
    C10H24AlNO12
    Molecular Weight
    377.28  g/mol
    InChI Key
    GJJYZOBRHIMORS-GQOAHPRESA-K
    FDA UNII
    I670EI8M2N
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    aluminum;2-amino-2-(hydroxymethyl)propane-1,3-diol;(2R,3S,4R,5R)-2,3,4,5,6-pentahydroxyhexanoate;dihydroxide
    2.1.2 InChI
    InChI=1S/C6H12O7.C4H11NO3.Al.2H2O/c7-1-2(8)3(9)4(10)5(11)6(12)13;5-4(1-6,2-7)3-8;;;/h2-5,7-11H,1H2,(H,12,13);6-8H,1-3,5H2;;2*1H2/q;;+3;;/p-3/t2-,3-,4+,5-;;;;/m1..../s1
    2.1.3 InChI Key
    GJJYZOBRHIMORS-GQOAHPRESA-K
    2.1.4 Canonical SMILES
    C(C(C(C(C(C(=O)[O-])O)O)O)O)O.C(C(CO)(CO)N)O.[OH-].[OH-].[Al+3]
    2.1.5 Isomeric SMILES
    C([C@H]([C@H]([C@@H]([C@H](C(=O)[O-])O)O)O)O)O.C(C(CO)(CO)N)O.[OH-].[OH-].[Al+3]
    2.2 Other Identifiers
    2.2.1 UNII
    I670EI8M2N
    2.3 Synonyms
    2.3.1 MeSH Synonyms

    1. Tasto

    2. Trometamolgluconate Aluminum

    2.3.2 Depositor-Supplied Synonyms

    1. Tasto

    2. 13755-41-4

    3. I670ei8m2n

    4. Tris(hydroxymethyl)aminomethanegluconate Dihydroxyaluminate

    5. Aluminum;2-amino-2-(hydroxymethyl)propane-1,3-diol;(2r,3s,4r,5r)-2,3,4,5,6-pentahydroxyhexanoate;dihydroxide

    6. Unii-i670ei8m2n

    7. Aloglutamol [who-dd]

    8. Dtxsid601027584

    9. Q4734171

    10. Dihydroxyaluminum Gluconate, Tris(hydroxymethyl)aminomethane (1:1)

    2.4 Create Date
    2014-03-02
    3 Chemical and Physical Properties
    Molecular Weight 377.28 g/mol
    Molecular Formula C10H24AlNO12
    Hydrogen Bond Donor Count11
    Hydrogen Bond Acceptor Count13
    Rotatable Bond Count7
    Exact Mass377.1113886 g/mol
    Monoisotopic Mass377.1113886 g/mol
    Topological Polar Surface Area230 Ų
    Heavy Atom Count24
    Formal Charge0
    Complexity219
    Isotope Atom Count0
    Defined Atom Stereocenter Count4
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count5
    4 Pharmacology and Biochemistry
    4.1 ATC Code

    A - Alimentary tract and metabolism

    A02 - Drugs for acid related disorders

    A02A - Antacids

    A02AB - Aluminium compounds

    A02AB06 - Aloglutamol