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Magnesium Salicylate Tetrahydrate

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Also known as: 18917-95-8, Magnesium salicylate, Magnesium salicylate tetrahydrate, Backache caplets, Bayer select backache, 41728cy7ux

Molecular Formula

C₁₄H₁₈MgO₁₀

Molecular Weight

370.59 g/mol

InChI Key

NBQBEWAYWAMLJJ-UHFFFAOYSA-L

FDA UNII

41728CY7UX

1 2D Structure

Magnesium Salicylate Tetrahydrate

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

magnesium;2-carboxyphenolate;tetrahydrate

2.1.2 InChI

InChI=1S/2C7H6O3.Mg.4H2O/c2*8-6-4-2-1-3-5(6)7(9)10;;;;;/h2*1-4,8H,(H,9,10);;4*1H2/q;;+2;;;;/p-2

2.1.3 InChI Key

NBQBEWAYWAMLJJ-UHFFFAOYSA-L

2.1.4 Canonical SMILES

C1=CC=C(C(=C1)C(=O)O)[O-].C1=CC=C(C(=C1)C(=O)O)[O-].O.O.O.O.[Mg+2]

2.2 Other Identifiers

2.2.1 UNII

41728CY7UX

2.3 Synonyms

2.3.1 MeSH Synonyms

1. Keygesic-10

2. Magan

3. Magnesium Salicylate

4. Mobidin

5. Momentum (magnesium Salicylate)

2.3.2 Depositor-Supplied Synonyms

1. 18917-95-8

2. Magnesium Salicylate

3. Magnesium Salicylate Tetrahydrate

4. Backache Caplets

5. Bayer Select Backache

6. 41728cy7ux

7. Magnesium Salicylate (1:2), Tetrahydrate

8. 6150-94-3

9. Magnesiumsalicylatetetrahydrate

10. Chembl3989810

11. Dtxsid601015599

12. Magnesium Salicylate [inci]

13. Magnesium Salicylate [vandf]

14. Mfcd01766176

15. Magnesium Salicylate [usp-rs]

16. Magnesium Salicylate [who-dd]

17. Magnesium Salt Of 2-hydroxybenzoic Acid

18. Magnesium Salicylate [usp Monograph]

19. Magnesium 2-hydroxybenzoate Hydrate (1:2:4)

20. Magnesium Salicylate Tetrahydrate [mi]

21. Q20817210

22. Magnesium, Bis(2-(hydroxy-.kappa.o)benzoato-.kappa.o)-, Hydrate (1:4), (t-4)-

2.4 Create Date

2011-12-26

3 Chemical and Physical Properties

Molecular Formula	C₁₄H₁₈MgO₁₀
Molecular Weight	370.59 g/mol
Hydrogen Bond Donor Count	6
Hydrogen Bond Acceptor Count	10
Rotatable Bond Count	2
Exact Mass	370.0750385 g/mol
Monoisotopic Mass	370.0750385 g/mol
Topological Polar Surface Area	125 Å²
Heavy Atom Count	25
Formal Charge	0
Complexity	133
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently Bonded Unit Count	7

4 Pharmacology and Biochemistry

4.1 MeSH Pharmacological Classification

Anti-Inflammatory Agents, Non-Steroidal

Anti-inflammatory agents that are non-steroidal in nature. In addition to anti-inflammatory actions, they have analgesic, antipyretic, and platelet-inhibitory actions. They act by blocking the synthesis of prostaglandins by inhibiting cyclooxygenase, which converts arachidonic acid to cyclic endoperoxides, precursors of prostaglandins. Inhibition of prostaglandin synthesis accounts for their analgesic, antipyretic, and platelet-inhibitory actions; other mechanisms may contribute to their anti-inflammatory effects. (See all compounds classified as Anti-Inflammatory Agents, Non-Steroidal.)

Cyclooxygenase Inhibitors

Compounds or agents that combine with cyclooxygenase (PROSTAGLANDIN-ENDOPEROXIDE SYNTHASES) and thereby prevent its substrate-enzyme combination with arachidonic acid and the formation of eicosanoids, prostaglandins, and thromboxanes. (See all compounds classified as Cyclooxygenase Inhibitors.)

4.2 FDA Pharmacological Classification

4.2.1 Pharmacological Classes

Central Nervous System Stimulation [PE]; Methylxanthine [EPC]; Xanthines [CS]; Central Nervous System Stimulant [EPC]

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