Please Wait
Applying Filters...
Menu
Xls
2D Structure
Also known as: Magnesium gluconate, 3632-91-5, Magnesium gluconate anhydrous, Almora, Magnesium d-gluconate (1:2), 17140-79-3
Molecular Formula
C12H22MgO14
Molecular Weight
414.60  g/mol
InChI Key
CTUVIUYTHWPELF-IYEMJOQQSA-L
FDA UNII
TH52F4317B

1 2D Structure

2D Structure

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
magnesium;(2R,3S,4R,5R)-2,3,4,5,6-pentahydroxyhexanoate
2.1.2 InChI
InChI=1S/2C6H12O7.Mg/c2*7-1-2(8)3(9)4(10)5(11)6(12)13;/h2*2-5,7-11H,1H2,(H,12,13);/q;;+2/p-2/t2*2-,3-,4+,5-;/m11./s1
2.1.3 InChI Key
CTUVIUYTHWPELF-IYEMJOQQSA-L
2.1.4 Canonical SMILES
C(C(C(C(C(C(=O)[O-])O)O)O)O)O.C(C(C(C(C(C(=O)[O-])O)O)O)O)O.[Mg+2]
2.1.5 Isomeric SMILES
C([C@H]([C@H]([C@@H]([C@H](C(=O)[O-])O)O)O)O)O.C([C@H]([C@H]([C@@H]([C@H](C(=O)[O-])O)O)O)O)O.[Mg+2]
2.2 Other Identifiers
2.2.1 UNII
TH52F4317B
2.3 Synonyms
2.3.1 MeSH Synonyms

1. Boron Gluconate

2. D-gluconate

3. D-gluconic Acid

4. Dextronic Acid

5. Gluconate

6. Gluconic Acid

7. Gluconic Acid, (113)indium-labeled

8. Gluconic Acid, (14)c-labeled

9. Gluconic Acid, (159)dysprosium-labeled Salt

10. Gluconic Acid, (99)technecium (5+) Salt

11. Gluconic Acid, 1-(14)c-labeled

12. Gluconic Acid, 6-(14)c-labeled

13. Gluconic Acid, Aluminum (3:1) Salt

14. Gluconic Acid, Ammonium Salt

15. Gluconic Acid, Calcium Salt

16. Gluconic Acid, Cesium(+3) Salt

17. Gluconic Acid, Cobalt (2:1) Salt

18. Gluconic Acid, Copper Salt

19. Gluconic Acid, Fe(+2) Salt, Dihydrate

20. Gluconic Acid, Lanthanum(+3) Salt

21. Gluconic Acid, Magnesium (2:1) Salt

22. Gluconic Acid, Manganese (2:1) Salt

23. Gluconic Acid, Monolithium Salt

24. Gluconic Acid, Monopotassium Salt

25. Gluconic Acid, Monosodium Salt

26. Gluconic Acid, Potassium Salt

27. Gluconic Acid, Sodium Salt

28. Gluconic Acid, Strontium (2:1) Salt

29. Gluconic Acid, Tin(+2) Salt

30. Gluconic Acid, Zinc Salt

31. Lithium Gluconate

32. Magnerot

33. Magnesium Gluconate

34. Maltonic Acid

35. Manganese Gluconate

36. Pentahydroxycaproic Acid

37. Sodium Gluconate

38. Zinc Gluconate

2.3.2 Depositor-Supplied Synonyms

1. Magnesium Gluconate

2. 3632-91-5

3. Magnesium Gluconate Anhydrous

4. Almora

5. Magnesium D-gluconate (1:2)

6. 17140-79-3

7. Th52f4317b

8. Magnesium;(2r,3s,4r,5r)-2,3,4,5,6-pentahydroxyhexanoate

9. Magnesium Gluconate Hydrate

10. Glucomag

11. Glucosium

12. Menesia

13. Magnesium D-gluconate Hydrate

14. Gyn

15. Magnesium Digluconate

16. Unii-th52f4317b

17. Einecs 222-848-2

18. Magnesium (2r,3s,4r,5r)-2,3,4,5,6-pentahydroxyhexanoate

19. Magnesium(ii) Gluconate

20. Gluconic Acid, Magnesium Salt (2:1), D-

21. Schembl24660

22. Bis(d-gluconic Acid) Magnesium

23. Chembl2107145

24. Dtxsid50890579

25. Magnesiumd-gluconatehydrate

26. Gluconic Acid Magnesium(ii) Salt

27. Gluconic Acid Magnesium Salt

28. Magnesium Gluconate [who-dd]

29. Mfcd00150971

30. Akos025310186

31. Gluconic Acid Magnesium(ii) Salt Hydrate

32. As-17666

33. Gluconic Acid Magnesium Salt [mi]

34. G0276

35. E-580(magnesium Gluconate Anhydrous)

36. H11318

37. Ins-580(magnesium Gluconate Anhydrous)

38. Ins No.580(magnesium Gluconate Anhydrous)

39. Q6731392

2.4 Create Date
2006-10-26
3 Chemical and Physical Properties
Molecular Weight 414.60 g/mol
Molecular Formula C12H22MgO14
Hydrogen Bond Donor Count10
Hydrogen Bond Acceptor Count14
Rotatable Bond Count8
Exact Mass414.0859971 g/mol
Monoisotopic Mass414.0859971 g/mol
Topological Polar Surface Area283 Ų
Heavy Atom Count27
Formal Charge0
Complexity165
Isotope Atom Count0
Defined Atom Stereocenter Count8
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count3
4 Pharmacology and Biochemistry
4.1 ATC Code

A - Alimentary tract and metabolism

A12 - Mineral supplements

A12C - Other mineral supplements

A12CC - Magnesium

A12CC03 - Magnesium gluconate