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Chemistry

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Also known as: 7785-84-4, Trisodium trimetaphosphate, Sodium trimetaphosphate [usan], 3ih6169rl0, Cyclicsodiumtrimetaphosphate, Trisodium;2,4,6-trioxido-1,3,5,2lambda5,4lambda5,6lambda5-trioxatriphosphinane 2,4,6-trioxide
Molecular Formula
Na3O9P3
Molecular Weight
305.89  g/mol
InChI Key
UGTZMIPZNRIWHX-UHFFFAOYSA-K
FDA UNII
3IH6169RL0

Trimetaphosphoric Acid
1 2D Structure

Trimetaphosphoric Acid

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
trisodium;2,4,6-trioxido-1,3,5,25,45,65-trioxatriphosphinane 2,4,6-trioxide
2.1.2 InChI
InChI=1S/3Na.H3O9P3/c;;;1-10(2)7-11(3,4)9-12(5,6)8-10/h;;;(H,1,2)(H,3,4)(H,5,6)/q3*+1;/p-3
2.1.3 InChI Key
UGTZMIPZNRIWHX-UHFFFAOYSA-K
2.1.4 Canonical SMILES
[O-]P1(=O)OP(=O)(OP(=O)(O1)[O-])[O-].[Na+].[Na+].[Na+]
2.2 Other Identifiers
2.2.1 UNII
3IH6169RL0
2.3 Synonyms
2.3.1 MeSH Synonyms

1. Calcium Trimetaphosphate

2. Magnesium Trimetaphosphate

3. Trimetaphosphoric Acid

4. Trimetaphosphoric Acid, 99tc-labeled Cpd

5. Trimetaphosphoric Acid, Calcium (2:3) Salt, Hexahydrate

6. Trimetaphosphoric Acid, Magnesium (2:3) Salt

7. Trimetaphosphoric Acid, Magnesium (2:3) Salt, Dodecahydrate

8. Trimetaphosphoric Acid, Ruthenium (+3) Salt

9. Trimetaphosphoric Acid, Tripotassium Salt

10. Trimetaphosphoric Acid, Trisodium Salt

2.3.2 Depositor-Supplied Synonyms

1. 7785-84-4

2. Trisodium Trimetaphosphate

3. Sodium Trimetaphosphate [usan]

4. 3ih6169rl0

5. Cyclicsodiumtrimetaphosphate

6. Trisodium;2,4,6-trioxido-1,3,5,2lambda5,4lambda5,6lambda5-trioxatriphosphinane 2,4,6-trioxide

7. Sodium Trimetaphosphate (usan)

8. Trisodium Metaphosphate

9. Polyrinsan 58

10. Cyclic Sodium Trimetaphosphate

11. Sodium Phosphate ((napo3)3)

12. Hsdb 5048

13. Metaphosphoric Acid, Trisodium Salt

14. Sodium Metaphosphate (na3(p3o9))

15. Einecs 232-088-3

16. Trisodium Trimetaphosphate (na3p3o9)

17. Cyclisches Trinatriummetaphosphat [german]

18. Unii-3ih6169rl0

19. Ccris 8524

20. Cyclisches Trinatriummetaphosphat

21. Metaphosphoric Acid (h3p3o9), Trisodium Salt

22. Trimetaphosphoric Acid (h3p3o9), Trisodium Salt

23. 1,3,5,2,4,6-trioxatriphosphorinane, 2,4,6-trihydroxy-, Trisodium Salt

24. Ec 232-088-3

25. Chembl2107557

26. Dtxsid7052789

27. Trimetaphosphate Grade Iii Trisodium

28. Sodium Trimetaphosphate [ii]

29. Sodium Trimetaphosphate [mi]

30. Mfcd00867826

31. Sodium Trimetaphosphate [fcc]

32. Sodium Trimetaphosphate [hsdb]

33. Sodium Trimetaphosphate [inci]

34. Sodium Trimetaphosphate [vandf]

35. D02423

36. E75943

37. Metaphosphoric Acid (h3p3o9), Sodium Salt (1:3)

38. Q7553388

39. (triphosphoric Acid Alpha,beta,gamma-trisodium)alpha,gamma-anhydride Salt

40. 2,4,6-tris(sodiooxy)-1,3,5,2,4,6-trioxatriphosphorinane 2,4,6-trioxide

2.4 Create Date
2005-08-08
3 Chemical and Physical Properties
Molecular Weight 305.89 g/mol
Molecular Formula Na3O9P3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count9
Rotatable Bond Count0
Exact Mass305.84482541 g/mol
Monoisotopic Mass305.84482541 g/mol
Topological Polar Surface Area148 Ų
Heavy Atom Count15
Formal Charge0
Complexity224
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count4
4 Drug and Medication Information
4.1 Therapeutic Uses

Cariostatic Agents

National Library of Medicine's Medical Subject Headings online file (MeSH, 1999)


EXPTL USE: A 3-YR STUDY ON SCHOOL-AGE CHILDREN USING SODIUM TRIMETAPHOSPHATE AS A CHEWING GUM ADDITIVE PRODUCED REDUCTIONS IN PROXIMAL SURFACE DENTAL CARIES INCREMENTS AS COMPARED TO A NONCHEWING GUM GROUP. THE REDUCTIONS WERE 23.3% FOR THE SODIUM TRIMETAPHOSPHATE SUCROSE GUM GROUP & 47.6% FOR THE SODIUM TRIMETAPHOSPHATE NONSUGAR GROUP AS COMPARED TO THE NO-GUM GROUP. ... A MARGINAL EFFECT ON OVERALL CARIES INCREMENTS CAN BE ASCRIBED TO THE AGENT. THIS OVERALL EFFECT RESULTED FROM A SIGNIFICANT REDUCTION OF CARIES ON THE PROXIMAL SURFACES OF TEETH, ALTHOUGH OTHER SURFACES WERE NOT AS PROTECTED. ... THE LEVEL OF PROTECTION PROVIDED BY SODIUM TRIMETAPHOSPHATE IN THIS STUDY, OR BY DIETARY PHOSPHATES IN GENERAL, APPEARS SMALL RELATIVE TO OTHER CARIES-PREVENTING AGENTS, SUCH AS TOPICAL FLUORIDES.

PMID:273637 FINN SB ET AL; J AM DENT ASSOC 96 (4): 651-5 (1978)


SODIUM TRIMETAPHOSPHATE ADDED TO CHEWING GUM IS OF MARGINAL VALUE IN REDUCING DENTAL CARIES ON PROXIMAL SURFACES OF PERMANENT TEETH.

FINN SB ET AL; US NTIS PB REP ISS PB-273581 1-70 (1976)


5 Pharmacology and Biochemistry
5.1 MeSH Pharmacological Classification

Cariostatic Agents

Substances that inhibit or arrest DENTAL CARIES formation. (Boucher's Clinical Dental Terminology, 4th ed) (See all compounds classified as Cariostatic Agents.)


5.2 Absorption, Distribution and Excretion

... LITTLE, IF ANY, CYCLIC METAPHOSPHATE IS ABSORBED THRU INTESTINAL WALL WHEN ADMIN ORALLY. THE METAPHOSPHATES MUST FIRST BE HYDROLYZED TO TRIPOLYPHOSPHATE & NEXT TO ORTHOPHOSPHATE, WHICH THEN CAN BE ABSORBED.

Furia, T.E. (ed.). CRC Handbook of Food Additives. 2nd ed. Cleveland: The Chemical Rubber Co., 1972., p. 642


5.3 Mechanism of Action

Condensed phosphates (CP) used as food additives depressed the growth of 7 strains of Streptococcus mutans (serotype a-g) as assessed by disk diffusion methods. Minimal inhibitory concn (MIC) of condensed phosphates on Streptococcus mutans appeared to be related to their chelating capacity. The antibacterial action of condensed phosphates seemed largely bacteriostatic. Condensed phosphates depressed lactate production from glucose and sucrose by the cells of strain Kl-R. Condensed phosphates depressed insoluble glucan production from sucrose by the cells of Kl-R. The inhibition of sugar metabolism may be due to the interference of sugar transport into Streptococcus mutans induced by the chelation effects of condensed phosphates. Hamsters were inoculated orally with strain Kl-R and reared on the high-sucrose diet No 2000 supplemented with 2% (wt/wt) condensed phosphates for 60 days. Dietary supplements of condensed phosphates were associated with reduced caries activity and plaque formation.

PMID:6961893 Shibata H, Morioka T; Arch Oral Biol 27 (10): 809-16 (1982)


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