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Aminooxyacetic Acid

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Chemistry

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Also known as: 645-88-5, (aminooxy)acetic acid, 2-(aminooxy)acetic acid, Aoaa, Aminooxy-acetic acid, Carboxymethoxyamine

Molecular Formula

C₂H₅NO₃

Molecular Weight

91.07 g/mol

InChI Key

NQRKYASMKDDGHT-UHFFFAOYSA-N

FDA UNII

14I68GI3OQ

A compound that inhibits aminobutyrate aminotransferase activity in vivo, thereby raising the level of gamma-aminobutyric acid in tissues.

1 2D Structure

Aminooxyacetic Acid

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

2-aminooxyacetic acid

2.1.2 InChI

InChI=1S/C2H5NO3/c3-6-1-2(4)5/h1,3H2,(H,4,5)

2.1.3 InChI Key

NQRKYASMKDDGHT-UHFFFAOYSA-N

2.1.4 Canonical SMILES

C(C(=O)O)ON

2.2 Other Identifiers

2.2.1 UNII

14I68GI3OQ

2.3 Synonyms

2.3.1 MeSH Synonyms

1. Acid, Aminooxyacetic

2. Aminooxyacetate

3. Carboxymethoxyamine

2.3.2 Depositor-Supplied Synonyms

1. 645-88-5

2. (aminooxy)acetic Acid

3. 2-(aminooxy)acetic Acid

4. Aoaa

5. Aminooxy-acetic Acid

6. Carboxymethoxyamine

7. Carboxymethoxylamine

8. Acetic Acid, (aminooxy)-

9. Aminoxyacetic Acid

10. (carboxymethoxy)amine

11. 2-aminooxyacetic Acid

12. (o-carboxymethyl)hydroxylamine

13. U-7524

14. 14i68gi3oq

15. Aoa

16. Hydroxylamine, O-(carboxymethyl)-

17. Aoa; Aoaa; U 7524; Alpha-aminooxyacetic Acid

18. Acetic Acid,2-(aminooxy)-

19. Brn 0878238

20. Unii-14i68gi3oq

21. U 7524

22. Aminoxy-acetic Acid

23. Amino-oxyacetic Acid

24. Aoa Hemihydrochloride

25. 2-aminooxyethanoic Acid

26. 2-(aminooxy)aceticacid

27. Acetic Acid, Aminooxy-

28. 2-(aminoxy)acetic Acid

29. Hydroxylamine Acetic Acid

30. Lopac-a-4508

31. Methoxyamine, 1-carboxy-

32. Lopac0_000007

33. Chembl347862

34. Gtpl5136

35. Chebi:40823

36. Dtxsid50214756

37. Bcp30347

38. Zinc4689151

39. Stl197511

40. Akos015919037

41. At14480

42. Ccg-204103

43. Db02079

44. Sb38109

45. Sdccgsbi-0049996.p002

46. Ncgc00015058-01

47. Ncgc00015058-02

48. Ncgc00015058-03

49. Ncgc00015058-04

50. Ncgc00162041-01

51. Ab00172543-06

52. A901703

53. Sr-01000075676

54. J-650057

55. Q4746466

56. Sr-01000075676-1

57. 396fbbc5-d28e-448c-a696-bf9163ea8b1a

58. 2-(aminooxy)acetic Acid Pound>>aoaa Pound>>u 7524 Pound>>u7524; U-7524 Pound>>hydroxylamine, O-(carboxymethyl)-

2.4 Create Date

2005-03-25

3 Chemical and Physical Properties

Molecular Formula	C₂H₅NO₃
Molecular Weight	91.07 g/mol
XLogP3	-3.4
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	2
Exact Mass	91.026943022 g/mol
Monoisotopic Mass	91.026943022 g/mol
Topological Polar Surface Area	72.6 Å²
Heavy Atom Count	6
Formal Charge	0
Complexity	52.8
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

4 Pharmacology and Biochemistry

4.1 MeSH Pharmacological Classification

GABA Agents

Substances used for their pharmacological actions on GABAergic systems. GABAergic agents include agonists, antagonists, degradation or uptake inhibitors, depleters, precursors, and modulators of receptor function. (See all compounds classified as GABA Agents.)

Enzyme Inhibitors

Compounds or agents that combine with an enzyme in such a manner as to prevent the normal substrate-enzyme combination and the catalytic reaction. (See all compounds classified as Enzyme Inhibitors.)

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