672-15-1

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Chemistry

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Also known as: 672-15-1, Homoserine, (2s)-2-amino-4-hydroxybutanoic acid, (s)-2-amino-4-hydroxybutanoic acid, H-hoser-oh, (s)-2-amino-4-hydroxybutyric acid

Molecular Formula

C₄H₉NO₃

Molecular Weight

119.12 g/mol

InChI Key

UKAUYVFTDYCKQA-VKHMYHEASA-N

FDA UNII

6KA95X0IVO

L-Homoserine is a metabolite found in or produced by Escherichia coli (strain K12, MG1655).

1 2D Structure

672-15-1

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

(2S)-2-amino-4-hydroxybutanoic acid

2.1.2 InChI

InChI=1S/C4H9NO3/c5-3(1-2-6)4(7)8/h3,6H,1-2,5H2,(H,7,8)/t3-/m0/s1

2.1.3 InChI Key

UKAUYVFTDYCKQA-VKHMYHEASA-N

2.1.4 Canonical SMILES

C(CO)C(C(=O)O)N

2.1.5 Isomeric SMILES

C(CO)[C@@H](C(=O)O)N

2.2 Other Identifiers

2.2.1 UNII

6KA95X0IVO

2.3 Synonyms

2.3.1 MeSH Synonyms

1. Homoserine

2. Homoserine L-isomer

3. L Isomer Of Homoserine

4. L-isomer Of Homoserine

2.3.2 Depositor-Supplied Synonyms

1. 672-15-1

2. Homoserine

3. (2s)-2-amino-4-hydroxybutanoic Acid

4. (s)-2-amino-4-hydroxybutanoic Acid

5. H-hoser-oh

6. (s)-2-amino-4-hydroxybutyric Acid

7. (s)-homoserine

8. Homoserine (van)

9. H-hse-oh

10. Mfcd00063090

11. 2-amino-4-hydroxybutyric Acid

12. 119736-88-8

13. (2s)-2-ammonio-4-hydroxybutanoate

14. 6ka95x0ivo

15. Butyric Acid, 2-amino-4-hydroxy-, L-

16. Butanoic Acid, 2-amino-4-hydroxy-, (s)-

17. Chebi:15699

18. Hse

19. 2-amino-4-hydroxybutanoate

20. Unii-6ka95x0ivo

21. 2-amino-4-hydroxy-butyric Acid

22. Isothreonine

23. 2-amino-4-hydroxybutyrate

24. Nsc-206251

25. Einecs 211-590-6

26. Nsc 206251

27. Homoserine [mi]

28. Homoserine, L-

29. Bmse000040

30. 2-amino-4-hydroxy-butyrate

31. Schembl29649

32. Chembl11722

33. 2-amino-4-hydroxy-l-butyrate

34. Dtxsid5075159

35. (s)-2-amino-4-hydroxybutanoate

36. L-2-amino-4-hydroxybutyric Acid

37. (s)-2-amino-4-hydroxy-butanoate

38. 2-amino-4-hydroxy-l-butyric Acid

39. Str06869

40. S3118

41. (s)-2-amino-4-hydroxy-butanoic Acid

42. Akos005146323

43. Akos016015443

44. Ac-5665

45. Cs-w002292

46. Db04193

47. Hy-w002292

48. S-2-amino-4-hydroxybutyric Acid

49. (s)-2-amino-4-hydroxybutyric Acid, Hse

50. Bp-13218

51. L-homoserine,labeledwith Carbon-14(9ci)

52. Am20100617

53. H1030

54. En300-75344

55. C00263

56. (s)-(-)-2-amino-4-hydroxybutyric Acid

57. Butyric Acid, 2-amino-4-hydroxy-, L- (8ci)

58. A835661

59. Q418214

60. Z1172369006

61. 09ec5004-e0f7-4325-b392-59a264daf51f

2.4 Create Date

2004-09-16

3 Chemical and Physical Properties

Molecular Formula	C₄H₉NO₃
Molecular Weight	119.12 g/mol
XLogP3	-4.4
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	3
Exact Mass	g/mol
Monoisotopic Mass	g/mol
Topological Polar Surface Area	83.6
Heavy Atom Count	8
Formal Charge	0
Complexity	83.4
Isotope Atom Count	0
Defined Atom Stereocenter Count	1
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently Bonded Unit Count	1