CAS 3387-36-8

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Also known as: 3387-36-8, Disodium ump, Uridine 5'-monophosphate disodium salt, Disodium 5'-uridylate, 5'-uridylic acid disodium salt, 5'-uridylic acid, disodium salt

Molecular Formula

C₉H₁₁N₂Na₂O₉P

Molecular Weight

368.14 g/mol

InChI Key

KURVIXMFFSNONZ-WFIJOQBCSA-L

FDA UNII

KD8E20071T

1 2D Structure

CAS 3387-36-8

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

disodium;[(2R,3S,4R,5R)-5-(2,4-dioxopyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methyl phosphate

2.1.2 InChI

InChI=1S/C9H13N2O9P.2Na/c12-5-1-2-11(9(15)10-5)8-7(14)6(13)4(20-8)3-19-21(16,17)18;;/h1-2,4,6-8,13-14H,3H2,(H,10,12,15)(H2,16,17,18);;/q;2*+1/p-2/t4-,6-,7-,8-;;/m1../s1

2.1.3 InChI Key

KURVIXMFFSNONZ-WFIJOQBCSA-L

2.1.4 Canonical SMILES

C1=CN(C(=O)NC1=O)C2C(C(C(O2)COP(=O)([O-])[O-])O)O.[Na+].[Na+]

2.1.5 Isomeric SMILES

C1=CN(C(=O)NC1=O)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)([O-])[O-])O)O.[Na+].[Na+]

2.2 Other Identifiers

2.2.1 UNII

KD8E20071T

2.3 Synonyms

2.3.1 Depositor-Supplied Synonyms

1. 3387-36-8

2. Disodium Ump

3. Uridine 5'-monophosphate Disodium Salt

4. Disodium 5'-uridylate

5. 5'-uridylic Acid Disodium Salt

6. 5'-uridylic Acid, Disodium Salt

7. Uridine Monophosphate Disodium

8. 5'-ump Disodium Salt

9. Uridine-5'-monophosphate Disodium Salt

10. Uridine 5'-monophosphate, Disodium Salt

11. Uridine-5'-phosphoric Acid Disodium Salt

12. Disodium Uridine-5-monophosphate

13. Kd8e20071t

14. Sodium ((2r,3s,4r,5r)-5-(2,4-dioxo-3,4-dihydropyrimidin-1(2h)-yl)-3,4-dihydroxytetrahydrofuran-2-yl)methyl Phosphate

15. Ump Sodium Salt

16. Sodium Ump

17. Disodium 5'-ump

18. 5'-uridylic Acid, Sodium Salt

19. Uridylic Acid Sodium Salt

20. Mfcd00006525

21. Uridine 5'mp, Disodium Salt

22. Sodium Uridine-5'-phosphate

23. 5'-ump Disodium

24. Disodium Uridine 5'-phosphate

25. Disodium Uridine 5'-monophosphate

26. Nsc 20257

27. Unii-kd8e20071t

28. Ccris 6562

29. Einecs 222-211-9

30. Uridine-5-monophosphate Disodium Salt

31. Nsc-20257

32. 5'-uridine Monophosphate

33. Uridine, 5'-dihydrogen Phosphate, Disodium Salt

34. 5'-ump 2na

35. 5'-ump-na2

36. Disodium Uridine Monophosphate

37. 5-ump-2na

38. Schembl842020

39. Disodiumuridine-5-monophosphate

40. Uridine 5-mo-phos Disod

41. Disodium Uridine Phosphate

42. Uridine-5'-monophosphate Disodium

43. Uridine 5'-monophosphate Disodium

44. Dtxsid101342721

45. Disodium 5'-uridylate [fcc]

46. Hg1370

47. Akos016008394

48. Ccg-268259

49. Disodium 5'-uridylate [usp-rs]

50. Disodium Uridine Phosphate [inci]

51. Ac-32137

52. As-12296

53. U0021

54. 5'-uridylic Acid, Sodium Salt (1:2)

55. Disodium Uridine Monophosphate [who-dd]

56. Uridine 5' -monophosphate Disodium Salt

57. Uridine 5'-monophosphate Disodium Salt, >=99%

58. 5-hydroxyl-uridine-5'-monophosphate, Disodium Salt

59. J-700094

60. Q27282199

61. Disodium 5'-uridylate, United States Pharmacopeia (usp) Reference Standard

62. Disodium;[(2r,3s,4r,5r)-5-(2,4-dioxopyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methyl Phosphate

2.4 Create Date

2005-07-19

3 Chemical and Physical Properties

Molecular Formula	C₉H₁₁N₂Na₂O₉P
Molecular Weight	368.14 g/mol
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	9
Rotatable Bond Count	3
Exact Mass	367.99975549 g/mol
Monoisotopic Mass	367.99975549 g/mol
Topological Polar Surface Area	172 Å²
Heavy Atom Count	23
Formal Charge	0
Complexity	506
Isotope Atom Count	0
Defined Atom Stereocenter Count	4
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently Bonded Unit Count	3