Also known as: 543-24-8, Aceturic acid, Acetamidoacetic acid, 2-acetamidoacetic acid, Ac-gly-oh, Acetylglycine

Molecular Formula

C₄H₇NO₃

Molecular Weight

117.10 g/mol

InChI Key

OKJIRPAQVSHGFK-UHFFFAOYSA-N

FDA UNII

U2UT4677KR

acetylamino-acetic acid is a natural product found in Candida tropicalis, Drosophila melanogaster, and Homo sapiens with data available.

1 2D Structure

2D Structure

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

2-acetamidoacetic acid

2.1.2 InChI

InChI=1S/C4H7NO3/c1-3(6)5-2-4(7)8/h2H2,1H3,(H,5,6)(H,7,8)

2.1.3 InChI Key

OKJIRPAQVSHGFK-UHFFFAOYSA-N

2.1.4 Canonical SMILES

CC(=O)NCC(=O)O

2.2 Other Identifiers

2.2.1 UNII

U2UT4677KR

2.3 Synonyms

2.3.1 MeSH Synonyms

1. Aceturic Acid

2. Acetylglycinate

2.3.2 Depositor-Supplied Synonyms

1. 543-24-8

2. Aceturic Acid

3. Acetamidoacetic Acid

4. 2-acetamidoacetic Acid

5. Ac-gly-oh

6. Acetylglycine

7. Glycine, N-acetyl-

8. Acetylaminoacetic Acid

9. Acetylglycocoll

10. Acetylamino-acetic Acid

11. Ethanoylaminoethanoic Acid

12. N-acetyl-glycine

13. (acetylamino)acetic Acid

14. Acetyl-glycine

15. Acetyl Glycine

16. 2-(acetylamino)acetic Acid

17. 2-acetamidoacetate

18. Nsc 7605

19. Mfcd00004275

20. U2ut4677kr

21. Chebi:40410

22. Aceturate

23. Nsc-7605

24. Acetamidoacetate

25. N-acetylglycine Sodium Salt

26. Unii-u2ut4677kr

27. Acetyl-glycin

28. N-acetyl Glycine

29. Ac Gly

30. Einecs 208-839-6

31. Ethanoylaminoethanoate

32. Ch3conhch2cooh

33. Substrate Analogue, 15

34. Ai3-17738

35. N-acetyl-l-glycine

36. Bmse000610

37. Aceturic Acid [mi]

38. Schembl5876

39. 15n-acetylglycine A-radical

40. N-alpha-acetyl-glycine

41. Chembl289004

42. Dtxsid2043793

43. Bdbm82197

44. Nsc7605

45. Act08307

46. Albb-019763

47. Hy-y0069

48. Zinc1683660

49. Ac8343

50. Bbl020087

51. S3098

52. Stk256622

53. Akos000118774

54. Ab00351

55. Am81782

56. Cs-w020121

57. Db02713

58. N-acetylglycine, Reagentplus(r), 99%

59. Ncgc00320093-01

60. Ac-24104

61. As-12785

62. Sy013515

63. Db-030111

64. A0093

65. Eu-0096429

66. Ft-0629819

67. A-1250

68. Ab00374931-02

69. Ab00374931-04

70. N-acetylglycine, Vetec(tm) Reagent Grade, 98%

71. 10.14272/okjirpaqvshgfk-uhfffaoysa-n.1

72. 543a248

73. Ab-131/40177771

74. N-acetylglycine Acetylglycine Acetamidoacetic Acid

75. Doi:10.14272/okjirpaqvshgfk-uhfffaoysa-n.1

76. Q15634040

77. Z85886676

78. 19fc14b9-9bf4-46b1-9a63-d3b6cfb535ed

79. F0921-6976

2.4 Create Date

2005-03-26

3 Chemical and Physical Properties

Molecular Formula	C₄H₇NO₃
Molecular Weight	117.10 g/mol
XLogP3	-1.2
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	2
Exact Mass	117.042593085 g/mol
Monoisotopic Mass	117.042593085 g/mol
Topological Polar Surface Area	66.4 Å²
Heavy Atom Count	8
Formal Charge	0
Complexity	110
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently Bonded Unit Count	1

N-Acetylglycine

N-Acetylglycine

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