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    Technical details about Dimecrotate Magnesium, learn more about the structure, uses, toxicity, action, side effects and more

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    Dimecrotate Magnesium

    PharmaCompass

    Farmhispania Group, a leading European CDMO in HPAPI Technologies & High Potency Fermentation.

    One Pharma aims to be one of the leading generic companies in Europe.

    2D Structure
    1. Also known as: Hepadial, 54283-65-7, Dimecrotate magnesium, Magnesium (z)-3-(2,4-dimethoxyphenyl)but-2-enoate, 1iz92dem5b, Magnesium;(z)-3-(2,4-dimethoxyphenyl)but-2-enoate
    Molecular Formula
    C24H26MgO8
    Molecular Weight
    466.8  g/mol
    InChI Key
    NRMWCJKNPLZLMY-HIGYRTBYSA-L
    FDA UNII
    1IZ92DEM5B
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    magnesium;(Z)-3-(2,4-dimethoxyphenyl)but-2-enoate
    2.1.2 InChI
    InChI=1S/2C12H14O4.Mg/c2*1-8(6-12(13)14)10-5-4-9(15-2)7-11(10)16-3;/h2*4-7H,1-3H3,(H,13,14);/q;;+2/p-2/b2*8-6-;
    2.1.3 InChI Key
    NRMWCJKNPLZLMY-HIGYRTBYSA-L
    2.1.4 Canonical SMILES
    CC(=CC(=O)[O-])C1=C(C=C(C=C1)OC)OC.CC(=CC(=O)[O-])C1=C(C=C(C=C1)OC)OC.[Mg+2]
    2.1.5 Isomeric SMILES
    C/C(=C/C(=O)[O-])/C1=C(C=C(C=C1)OC)OC.C/C(=C/C(=O)[O-])/C1=C(C=C(C=C1)OC)OC.[Mg+2]
    2.2 Other Identifiers
    2.2.1 UNII
    1IZ92DEM5B
    2.3 Synonyms
    2.3.1 Depositor-Supplied Synonyms

    1. Hepadial

    2. 54283-65-7

    3. Dimecrotate Magnesium

    4. Magnesium (z)-3-(2,4-dimethoxyphenyl)but-2-enoate

    5. 1iz92dem5b

    6. Magnesium;(z)-3-(2,4-dimethoxyphenyl)but-2-enoate

    7. Magnesium 3-(2,4-dimethoxyphenyl)-2-butenoate

    8. Unii-1iz92dem5b

    9. 26011-83-6

    10. Fisiobil

    11. (z)-3-(2,4-dimethoxyphenyl)crotonic Acid Magnesium Salt

    12. 2-butenoic Acid, 3-(2,4-dimethoxyphenyl)-, Magnesium Salt, (z)-

    13. Magnesium Salz Der (2,4-dimethoxyphenyl)-3-crotonsaeure [german]

    14. Dimecrotic Acid Magnesium

    15. Magnesium Salz Der (2,4-dimethoxyphenyl)-3-crotonsaeure

    16. Cinnamic Acid, 2,4-dimethoxy-beta-methyl-, Magnesium Salt, (z)-

    17. Dimecrotic Acid Magnesium Salt [mi]

    18. Dimecrotic Acid Magnesium Salt [who-dd]

    19. A830080

    20. Q27252472

    21. Magnesium Cis-3-(2,4-dimethoxyphenyl)crotonate

    22. Bis[3-(2,4-dimethoxyphenyl)-2-butenoic Acid]magnesium Salt

    23. 2-butenoic Acid, 3-(2,4-dimethoxyphenyl)-, Magnesium Salt (2:1), (2z)-

    2.4 Create Date
    2006-04-29
    3 Chemical and Physical Properties
    Molecular Weight 466.8 g/mol
    Molecular Formula C24H26MgO8
    Hydrogen Bond Donor Count0
    Hydrogen Bond Acceptor Count8
    Rotatable Bond Count6
    Exact Mass466.1478095 g/mol
    Monoisotopic Mass466.1478095 g/mol
    Topological Polar Surface Area117 Ų
    Heavy Atom Count33
    Formal Charge0
    Complexity267
    Isotope Atom Count0
    Defined Atom Stereocenter Count0
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count2
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count3
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