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Chemistry

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Also known as: 6113-61-7, N-formyl-leu-oh, N-formylleucine, L-leucine, n-formyl-, (2s)-2-formamido-4-methylpentanoic acid, 5tha63y4ff
Molecular Formula
C7H13NO3
Molecular Weight
159.18  g/mol
InChI Key
HFBHOAHFRNLZGN-LURJTMIESA-N
FDA UNII
5THA63Y4FF

N-Formyl-L-Leucine
1 2D Structure

N-Formyl-L-Leucine

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
(2S)-2-formamido-4-methylpentanoic acid
2.1.2 InChI
InChI=1S/C7H13NO3/c1-5(2)3-6(7(10)11)8-4-9/h4-6H,3H2,1-2H3,(H,8,9)(H,10,11)/t6-/m0/s1
2.1.3 InChI Key
HFBHOAHFRNLZGN-LURJTMIESA-N
2.1.4 Canonical SMILES
CC(C)CC(C(=O)O)NC=O
2.1.5 Isomeric SMILES
CC(C)C[C@@H](C(=O)O)NC=O
2.2 Other Identifiers
2.2.1 UNII
5THA63Y4FF
2.3 Synonyms
2.3.1 Depositor-Supplied Synonyms

1. 6113-61-7

2. N-formyl-leu-oh

3. N-formylleucine

4. L-leucine, N-formyl-

5. (2s)-2-formamido-4-methylpentanoic Acid

6. 5tha63y4ff

7. (s)-2-formamido-4-methylpentanoic Acid

8. (s)-(+)-2-formamido-4-methylpentanoic Acid

9. N-formylleucine #

10. Unii-5tha63y4ff

11. Formylleucine

12. Formylleucin

13. Formyl-l-leucine

14. N-formyl L-leu

15. N-formyl Leucine

16. Nsc-334321

17. N-formyl-s-leucine

18. Einecs 228-080-4

19. For-leu-oh

20. N-formyl L Leucine

21. Mfcd00055861

22. N-formyl-(s)-leucine

23. N-formyl-leu-oh, 90%

24. Schembl1399853

25. Dtxsid90878997

26. Zinc402913

27. Hy-i0591

28. Formylleucine [usp Impurity]

29. Bbl104007

30. Ethyleneglycolbis(3-aminopropyl)ether

31. Stl557818

32. N-formyl-l-leucine (for-l-leu-oh)

33. Akos005255679

34. Akos010389171

35. Ds-9758

36. Nsc 334321

37. Cs-0009546

38. F0131

39. I11527

40. 113f617

41. A868797

42. Q27262845

2.4 Create Date
2006-10-25
3 Chemical and Physical Properties
Molecular Weight 159.18 g/mol
Molecular Formula C7H13NO3
XLogP30.9
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count4
Exact Mass159.08954328 g/mol
Monoisotopic Mass159.08954328 g/mol
Topological Polar Surface Area66.4 Ų
Heavy Atom Count11
Formal Charge0
Complexity145
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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09-Jul-2021
21-Oct-2023
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