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Chemistry

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Also known as: 338-69-2, (2r)-2-aminopropanoic acid, (r)-alanine, H-d-ala-oh, D-2-aminopropionic acid, D-ala
Molecular Formula
C3H7NO2
Molecular Weight
89.09  g/mol
InChI Key
QNAYBMKLOCPYGJ-UWTATZPHSA-N
FDA UNII
E3UDS4613U

D-Alanine
D-Alanine is a metabolite found in or produced by Escherichia coli (strain K12, MG1655).
1 2D Structure

D-Alanine

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
(2R)-2-aminopropanoic acid
2.1.2 InChI
InChI=1S/C3H7NO2/c1-2(4)3(5)6/h2H,4H2,1H3,(H,5,6)/t2-/m1/s1
2.1.3 InChI Key
QNAYBMKLOCPYGJ-UWTATZPHSA-N
2.1.4 Canonical SMILES
CC(C(=O)O)N
2.1.5 Isomeric SMILES
C[C@H](C(=O)O)N
2.2 Other Identifiers
2.2.1 UNII
E3UDS4613U
2.3 Synonyms
2.3.1 Depositor-Supplied Synonyms

1. 338-69-2

2. (2r)-2-aminopropanoic Acid

3. (r)-alanine

4. H-d-ala-oh

5. D-2-aminopropionic Acid

6. D-ala

7. (r)-2-aminopropanoic Acid

8. D-alpha-alanine

9. Alanine, D-

10. Alanine D-form

11. (r)-2-aminopropionic Acid

12. Ba 2776

13. D-(-)-alanine

14. D-alpha-aminopropionsaeure

15. (r)-2-aminopropionsaeure

16. D-alanin

17. D-alpha-aminopropionic Acid

18. D-.alpha.-alanine

19. (2r)-2-azaniumylpropanoate

20. Chembl66693

21. E3uds4613u

22. Chebi:15570

23. Dal

24. Ncgc00024493-02

25. Mfcd00008077

26. Dsstox_cid_25649

27. Dsstox_rid_81027

28. Dsstox_gsid_45649

29. Cas-338-69-2

30. D(-)-.alpha.-alanine

31. Unii-e3uds4613u

32. Delta-alanine

33. D-a-alanine

34. R Alanine

35. Nsc-158286

36. (d)-alanine

37. Delta-alpha-alanine

38. Einecs 206-418-1

39. 3h-d-ala

40. Delta-(-)-alanine

41. Nsc 158286

42. D(-)-alpha-alanine

43. D(-)-a -alanine

44. Tocris-0204

45. D-alanine, >=99%

46. Bmse000236

47. Delta-2-aminopropionic Acid

48. (r)-2-amino Propionic Acid

49. Alanine D-form [mi]

50. Gtpl4678

51. (2r)-2-(amino)propanoic Acid

52. Dtxsid3045649

53. D-alanine, >=98% (hplc)

54. Act07928

55. Zinc4658556

56. Tox21_110903

57. Bdbm50000109

58. S3203

59. Akos015840336

60. Tox21_110903_1

61. Cs-w020127

62. Db01786

63. Ncgc00024493-01

64. Ncgc00024493-03

65. Ncgc00024494-02

66. As-56052

67. Hy-41700

68. A0177

69. Am20090517

70. D-alanine, Vetec(tm) Reagent Grade, >=98%

71. 38a692

72. A-4200

73. C00133

74. M02932

75. A847287

76. Sr-01000597686

77. Sr-01000597686-3

78. Q27076975

79. Z1259273326

80. 0c450b43-c901-4435-9e74-051222d815ea

2.4 Create Date
2004-09-16
3 Chemical and Physical Properties
Molecular Weight 89.09 g/mol
Molecular Formula C3H7NO2
XLogP3-3
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count1
Exact Mass89.047678466 g/mol
Monoisotopic Mass89.047678466 g/mol
Topological Polar Surface Area63.3 Ų
Heavy Atom Count6
Formal Charge0
Complexity61.8
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1

API Reference Price

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PU DONG","customer":"PIRAMAL PHARMA SOLUTIONS","customerCountry":"INDIA","quantity":"4.70","actualQuantity":"4.7","unit":"KGS","unitRateFc":"1570","totalValueFC":"8047.6","currency":"USD","unitRateINR":"143622","date":"14-Aug-2024","totalValueINR":"675023.4","totalValueInUsd":"8047.6","indian_port":"Bombay Air","hs_no":"29242990","bill_no":"5048110","productDescription":"API","marketType":"REGULATED MARKET","country":"CHINA","selfForZScoreResived":"Pharma Grade","supplierPort":"SHANGHAI - PU DONG","supplierAddress":"519 ZIYUE ROAD, MINHANG SHANGHAI 200241 Shanghai, , ChinaSDNF China","customerAddress":"PIRAMAL ANANTA, PIRAMAL AGASTYA PARK"}]
11-Feb-2021
14-Aug-2024
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