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Also known as: 13035-61-5, Tetra-o-acetyl-beta-d-ribofuranose, 1,2,3,5-tetra-o-acetyl-beta-d-ribofuranose, Tetraacetylribose, 1,2,3,5-tetra-o-acetyl-b-d-ribofuranose, (2s,3r,4r,5r)-5-(acetoxymethyl)tetrahydrofuran-2,3,4-triyl triacetate
Molecular Formula
C13H18O9
Molecular Weight
318.28  g/mol
InChI Key
IHNHAHWGVLXCCI-FDYHWXHSSA-N

CAS 13035-61-5
1 2D Structure

CAS 13035-61-5

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
[(2R,3R,4R,5S)-3,4,5-triacetyloxyoxolan-2-yl]methyl acetate
2.1.2 InChI
InChI=1S/C13H18O9/c1-6(14)18-5-10-11(19-7(2)15)12(20-8(3)16)13(22-10)21-9(4)17/h10-13H,5H2,1-4H3/t10-,11-,12-,13-/m1/s1
2.1.3 InChI Key
IHNHAHWGVLXCCI-FDYHWXHSSA-N
2.1.4 Canonical SMILES
CC(=O)OCC1C(C(C(O1)OC(=O)C)OC(=O)C)OC(=O)C
2.1.5 Isomeric SMILES
CC(=O)OC[C@@H]1[C@H]([C@H]([C@@H](O1)OC(=O)C)OC(=O)C)OC(=O)C
2.2 Synonyms
2.2.1 Depositor-Supplied Synonyms

1. 13035-61-5

2. Tetra-o-acetyl-beta-d-ribofuranose

3. 1,2,3,5-tetra-o-acetyl-beta-d-ribofuranose

4. Tetraacetylribose

5. 1,2,3,5-tetra-o-acetyl-b-d-ribofuranose

6. (2s,3r,4r,5r)-5-(acetoxymethyl)tetrahydrofuran-2,3,4-triyl Triacetate

7. 1,2,3,5-tetraacetyl-.-d-ribofuranose

8. Tetra-o-acetyl-b-d-ribofuranose

9. 1,2,3,5-tetraacetyl-beta-d-ribofuranose

10. .beta.-d-ribofuranose, Tetraacetate

11. Einecs 235-898-5

12. [(2r,3r,4r,5s)-3,4,5-triacetyloxyoxolan-2-yl]methyl Acetate

13. Ribofuranose, Tetraacetate, .beta.-d-

14. 1,2,3,5-tetra-o-acetyl Beta-d-ribofuranose

15. Tetra-o-acetyl-.beta.-d-ribofuranose

16. Tetraacetylribofuranose

17. 1,2,3,5-tetra-o-acetylpentofuranose #

18. Mfcd00005358

19. (2r,3r,4r,5s)-4,5-bis(acetyloxy)-2-[(acetyloxy)methyl]tetrahydro-3-furanyl Acetate

20. 1,2,3,5-tetraacetyl-

21. A-d-ribose

22. Ribofuranose Tetraacetate

23. Dsstox_cid_31421

24. Dsstox_rid_97307

25. Dsstox_gsid_57632

26. Schembl77518

27. Beta(r)-d-tetraacetyl Ribose

28. Chembl3183254

29. Dtxsid9057632

30. Tetraacetyl-beta-d-ribofuranoside

31. Beta-d-ribofuranose, Tetraacetate

32. 1,2,3,5-tetraacetoxy-b-d-ribose

33. Act03399

34. Zinc2169837

35. Tox21_113750

36. 1,2,3,5-tetraacetyl-beta-d-ribose

37. Nsc 18738

38. Akos015920139

39. Akos015995010

40. Ac-8170

41. Am83967

42. Cs-w019120

43. 1,2,3,5-tetraacetyl-b-d-ribofuranose

44. 1,2,3,5-tetraacetyl-ss-d-ribofuranose

45. Ncgc00253620-01

46. Ak-50517

47. Ds-15484

48. 1,2,3,5-tetraacetyl-.beta.-ribofuranose

49. Beta-d-ribofuranose-1,2,3,5-tetraacetate

50. Beta-d-(+)-ribose 1,2,3,5-tetraacetate

51. Cas-13035-61-5

52. Beta -d-ribofuranose 1,2,3,5-tetraacetate

53. R0066

54. .beta.-d-ribofuranose 1,2,3,5-tetraacetate

55. 1,2,3,5-tetra-o-acetyl-beta -d-ribofuranose

56. 1,2,3,5-tetra-o-acetyl-.beta.-d-ribofuranose

57. 035r615

58. A806070

59. Beta-d-ribofuranose 1,2,3,5-tetraacetate, 98%

60. Sr-01000944731

61. Sr-01000944731-1

62. Acetic Acid (2s,3r,4r,5r)-3,4-diacetoxy-5-acetoxymethyl-tetrahydro-furan-2-yl Ester

2.3 Create Date
2005-07-19
3 Chemical and Physical Properties
Molecular Weight 318.28 g/mol
Molecular Formula C13H18O9
XLogP30.7
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count9
Rotatable Bond Count9
Exact Mass318.09508215 g/mol
Monoisotopic Mass318.09508215 g/mol
Topological Polar Surface Area114 Ų
Heavy Atom Count22
Formal Charge0
Complexity458
Isotope Atom Count0
Defined Atom Stereocenter Count4
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1

BUILDING BLOCK

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