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2D Structure
Also known as: Sodium galactonate, D-gluconic acid sodium salt;sodium d-gluconate;d-gluconate sodium salt, Schembl23641, Bcp13391, Akos026749890, Sb45452
Molecular Formula
C6H11NaO7
Molecular Weight
218.14  g/mol
InChI Key
UPMFZISCCZSDND-UHFFFAOYSA-M

1 2D Structure

2D Structure

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
sodium;2,3,4,5,6-pentahydroxyhexanoate
2.1.2 InChI
InChI=1S/C6H12O7.Na/c7-1-2(8)3(9)4(10)5(11)6(12)13;/h2-5,7-11H,1H2,(H,12,13);/q;+1/p-1
2.1.3 InChI Key
UPMFZISCCZSDND-UHFFFAOYSA-M
2.1.4 Canonical SMILES
C(C(C(C(C(C(=O)[O-])O)O)O)O)O.[Na+]
2.2 Synonyms
2.2.1 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, Strontium (2:1) Salt

28. Gluconic Acid, Tin(+2) Salt

29. Gluconic Acid, Zinc Salt

30. Lithium Gluconate

31. Magnerot

32. Magnesium Gluconate

33. Maltonic Acid

34. Manganese Gluconate

35. Pentahydroxycaproic Acid

36. Sodium Gluconate

37. Zinc Gluconate

2.2.2 Depositor-Supplied Synonyms

1. Sodium Galactonate

2. D-gluconic Acid Sodium Salt;sodium D-gluconate;d-gluconate Sodium Salt

3. Schembl23641

4. Bcp13391

5. Akos026749890

6. Sb45452

7. Sodium Gluconate 45% (technical Grade)

8. Ft-0626723

9. Gluconate Sodium;d-gluconic Acid Sodium Salt; Sodium D-gluconate; D-gluconate Sodium Salt

2.3 Create Date
2005-03-27
3 Chemical and Physical Properties
Molecular Weight 218.14 g/mol
Molecular Formula C6H11NaO7
Hydrogen Bond Donor Count5
Hydrogen Bond Acceptor Count7
Rotatable Bond Count5
Exact Mass218.04024697 g/mol
Monoisotopic Mass218.04024697 g/mol
Topological Polar Surface Area141 Ų
Heavy Atom Count14
Formal Charge0
Complexity176
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count4
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count2