TATM

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Also known as: 92051-23-5, Tatm, 1,3,4,6-tetra-o-acetyl-2-o-(trifluoromethanesulfonyl)-beta-d-mannopyranose, 1,3,4,6-tetra-o-acetyl-2-o-trifluoromethanesulfonyl-beta-d-mannopyranose, 0ki8ffq6tt, 1,3,4,6-tetra-o-acetyl-2-o-trifluoromethanesulfonyl-b-d-mannopyranose

Molecular Formula

C₁₅H₁₉F₃O₁₂S

Molecular Weight

480.4 g/mol

InChI Key

OIBDVHSTOUGZTJ-PEBLQZBPSA-N

FDA UNII

0KI8FFQ6TT

1 2D Structure

TATM

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

[(2R,3R,4S,5S,6S)-3,4,6-triacetyloxy-5-(trifluoromethylsulfonyloxy)oxan-2-yl]methyl acetate

2.1.2 InChI

InChI=1S/C15H19F3O12S/c1-6(19)25-5-10-11(26-7(2)20)12(27-8(3)21)13(14(29-10)28-9(4)22)30-31(23,24)15(16,17)18/h10-14H,5H2,1-4H3/t10-,11-,12+,13+,14-/m1/s1

2.1.3 InChI Key

OIBDVHSTOUGZTJ-PEBLQZBPSA-N

2.1.4 Canonical SMILES

CC(=O)OCC1C(C(C(C(O1)OC(=O)C)OS(=O)(=O)C(F)(F)F)OC(=O)C)OC(=O)C

2.1.5 Isomeric SMILES

CC(=O)OC[C@@H]1[C@H]([C@@H]([C@@H]([C@@H](O1)OC(=O)C)OS(=O)(=O)C(F)(F)F)OC(=O)C)OC(=O)C

2.2 Other Identifiers

2.2.1 UNII

0KI8FFQ6TT

2.3 Synonyms

2.3.1 Depositor-Supplied Synonyms

1. 92051-23-5

2. Tatm

3. 1,3,4,6-tetra-o-acetyl-2-o-(trifluoromethanesulfonyl)-beta-d-mannopyranose

4. 1,3,4,6-tetra-o-acetyl-2-o-trifluoromethanesulfonyl-beta-d-mannopyranose

5. 0ki8ffq6tt

6. 1,3,4,6-tetra-o-acetyl-2-o-trifluoromethanesulfonyl-b-d-mannopyranose

7. Beta-d-mannopyranose 1,3,4,6-tetra-o-acetate 2-o-trifluoromethanesulfonate

8. [(2r,3r,4s,5s,6s)-3,4,6-triacetyloxy-5-(trifluoromethylsulfonyloxy)oxan-2-yl]methyl Acetate

9. 1,3,4,6-tetra-o-acetyl-2-o-trifluoro-methanesulfonyl-beta-d-mannopyranose

10. (2s,3s,4s,5r,6r)-6-(acetoxymethyl)-3-(((trifluoromethyl)sulfonyl)oxy)tetrahydro-2h-pyran-2,4,5-triyl Triacetate

11. Unii-0ki8ffq6tt

12. Mfcd00012353

13. Schembl543667

14. Dtxsid00238841

15. 1,3,4,6-tetra-o-acetyl-2-(trifluoromethylsulfonyl)betad-mannopyranose

16. 1,3,4,6-tetra-o-acetyl-2-o-trifluoromethylsulfonyl-b-d-mannopyranose

17. Zinc59230585

18. 1,3,4,6-tetra-o-acetyl-2-o-trifluoromethanesulfonylbetad-mannopyranose

19. Akos016010527

20. Akos024418732

21. Beta-d-mannopyranose, 1,3,4,6-tetraacetate 2-(trifluoromethanesulfonate)

22. As-15940

23. Cs-0017907

24. T2307

25. 051t235

26. Mannose Triflate, For Pet Imaging, >=98% (tlc)

27. W-204068

28. Q27236900

29. 1,3,4,6-tetra-o-acetyl-2-o-trifluormethanesulfonyl-beta-d-mannopyranose

30. 1,3,4,6-tetra-o-acetyl-2-o-trifluoromethanesulfonyl-?-d-mannopyranose

31. 1,3,4,6-tetraacetate-2-(trifluoromethane-sulphonate)-beta-d-mannopyranose

32. B-d-mannopyranose, 1,3,4,6-tetraacetate 2-(trifluoromethanesulfonate)

33. B-d-mannopyranose,1,3,4,6-tetraacetate 2-(trifluoromethanesulfonate)

34. .beta.-d-mannopyranose 1,3,4,6-tetra-o-acetate 2-o-trifluoromethanesulfonate

35. .beta.-d-mannopyranose, 1,3,4,6-tetraacetate 2-(trifluoromethanesulfonate)

36. 1,3,4,6-tetra-o-acetyl-2-(trifluoromethylsulfonyl)-.beta.-d-mannopyranose

37. 1,3,4,6-tetra-o-acetyl-2-o-trifluoromethanesulfonyl-.beta.-d-mannopyranose

38. Beta-d-mannopyranose 1,3,4,6-tetra-o-acetate 2-o-trifluoromethanesulfonate, 98%

39. Tetra-o-acetyl-mannose Triflate, European Pharmacopoeia (ep) Reference Standard

40. (2s,3s,4s,5r,6r)-6-(acetoxymethyl)-3-(((trifluoromethyl)sulfonyl)oxy)tetrahydro-2h-pyran-2,4,5-triyltriacetate

41. (2s,3s,4s,5r,6r)-6-(acetoxymethyl)-3-(trifluoromethylsulfonyloxy)tetrahydro-2h-pyran-2,4,5-triyl Triacetate

2.4 Create Date

2006-10-26

3 Chemical and Physical Properties

Molecular Formula	C₁₅H₁₉F₃O₁₂S
Molecular Weight	480.4 g/mol
XLogP3	1.4
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	15
Rotatable Bond Count	11
Exact Mass	480.05493170 g/mol
Monoisotopic Mass	480.05493170 g/mol
Topological Polar Surface Area	166 Å²
Heavy Atom Count	31
Formal Charge	0
Complexity	803
Isotope Atom Count	0
Defined Atom Stereocenter Count	5
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently Bonded Unit Count	1