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

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2D Structure
1. Also known as: 33433-82-8, Valproic acid calcium salt, Valproate calcium, Calcium;2-propylpentanoate, 56cck4f86g, Valontin
Molecular Formula
C16H30CaO4
Molecular Weight
326.48  g/mol
InChI Key
PIZHURYFCSGTJX-UHFFFAOYSA-L
FDA UNII
56CCK4F86G

A fatty acid with anticonvulsant and anti-manic properties that is used in the treatment of EPILEPSY and BIPOLAR DISORDER. The mechanisms of its therapeutic actions are not well understood. It may act by increasing GAMMA-AMINOBUTYRIC ACID levels in the brain or by altering the properties of VOLTAGE-GATED SODIUM CHANNELS.
1 2D Structure

2D Structure

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
calcium;2-propylpentanoate
2.1.2 InChI
InChI=1S/2C8H16O2.Ca/c2*1-3-5-7(6-4-2)8(9)10;/h2*7H,3-6H2,1-2H3,(H,9,10);/q;;+2/p-2
2.1.3 InChI Key
PIZHURYFCSGTJX-UHFFFAOYSA-L
2.1.4 Canonical SMILES
CCCC(CCC)C(=O)[O-].CCCC(CCC)C(=O)[O-].[Ca+2]
2.2 Other Identifiers
2.2.1 UNII
56CCK4F86G
2.3 Synonyms
2.3.1 MeSH Synonyms

1. 2 Propylpentanoic Acid

2. 2-propylpentanoic Acid

3. Convulsofin

4. Depakene

5. Depakine

6. Depakote

7. Dipropyl Acetate

8. Divalproex

9. Divalproex Sodium

10. Ergenyl

11. Magnesium Valproate

12. Propylisopropylacetic Acid

13. Semisodium Valproate

14. Sodium Valproate

15. Valproate

16. Valproate Calcium

17. Valproate Sodium

18. Valproic Acid

19. Valproic Acid, Sodium Salt (2:1)

20. Vupral

2.3.2 Depositor-Supplied Synonyms

1. 33433-82-8

2. Valproic Acid Calcium Salt

3. Valproate Calcium

4. Calcium;2-propylpentanoate

5. 56cck4f86g

6. Valontin

7. Calcium 2-propylpentanoate

8. Calcium Dipropylacetate

9. Valproic Acid Hemi-calcium Salt

10. Calcium Bis(2-propylpentanoate)

11. Dipropylacetic Acid Calcium Salt

12. 2-propylpentanoic Acid Calcium Salt

13. Dipropylacetate De Calcium [french]

14. Dipropylacetate De Calcium

15. Einecs 251-521-7

16. Unii-56cck4f86g

17. Pentanoic Acid, 2-propyl-, Calcium Salt

18. 2-propylvaleric Acid Calcium Salt (2:1)

19. Ccris 8570

20. Convulsofin (tn)

21. Valeric Acid, 2-propyl-, Calcium Salt (2:1)

22. Schembl139237

23. Dtxsid5020237

24. Akos015915492

25. D08667

26. Valeric Acid, 2-propyl-, Calcium Salt

27. Q27261400

28. Pentanoic Acid, 2-propyl-, Calcium Salt (2:1)

2.4 Create Date
2005-08-08
3 Chemical and Physical Properties
Molecular Weight 326.48 g/mol
Molecular Formula C16H30CaO4
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count8
Exact Mass326.1770003 g/mol
Monoisotopic Mass326.1770003 g/mol
Topological Polar Surface Area80.3 Ų
Heavy Atom Count21
Formal Charge0
Complexity87.9
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count3
4 Pharmacology and Biochemistry
4.1 MeSH Pharmacological Classification

Anticonvulsants

Drugs used to prevent SEIZURES or reduce their severity. (See all compounds classified as Anticonvulsants.)


GABA Agents

Substances used for their pharmacological actions on GABAergic systems. GABAergic agents include agonists, antagonists, degradation or uptake inhibitors, depleters, precursors, and modulators of receptor function. (See all compounds classified as GABA Agents.)


Antimanic Agents

Agents that are used to treat bipolar disorders or mania associated with other affective disorders. (See all compounds classified as Antimanic Agents.)


Enzyme Inhibitors

Compounds or agents that combine with an enzyme in such a manner as to prevent the normal substrate-enzyme combination and the catalytic reaction. (See all compounds classified as Enzyme Inhibitors.)


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