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ACTIVE PHARMA INGREDIENTS

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Chemistry

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Also known as: 5080-50-2, O-acetyl-l-carnitine hcl, O-acetyl-l-carnitine hydrochloride, Acetylcarnitine chloride, Acetylcarnitine hydrochloride, Nicetile

Molecular Formula

C₉H₁₈ClNO₄

Molecular Weight

239.69 g/mol

InChI Key

JATPLOXBFFRHDN-DDWIOCJRSA-N

FDA UNII

NDW10MX58T

An acetic acid ester of CARNITINE that facilitates movement of ACETYL COA into the matrices of mammalian MITOCHONDRIA during the oxidation of FATTY ACIDS.

1 2D Structure

Acetyl-L-Carnitine Hydrochloride

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

[(2R)-2-acetyloxy-3-carboxypropyl]-trimethylazanium;chloride

2.1.2 InChI

InChI=1S/C9H17NO4.ClH/c1-7(11)14-8(5-9(12)13)6-10(2,3)4;/h8H,5-6H2,1-4H3;1H/t8-;/m1./s1

2.1.3 InChI Key

JATPLOXBFFRHDN-DDWIOCJRSA-N

2.1.4 Canonical SMILES

CC(=O)OC(CC(=O)O)C[N+](C)(C)C.[Cl-]

2.1.5 Isomeric SMILES

CC(=O)O[C@H](CC(=O)O)C[N+](C)(C)C.[Cl-]

2.2 Other Identifiers

2.2.1 UNII

NDW10MX58T

2.3 Synonyms

2.3.1 MeSH Synonyms

1. Acetyl Carnitine

2. Acetyl L Carnitine

3. Acetyl-l-carnitine

4. Acetylcarnitine

5. Acetylcarnitine, (r)-isomer

6. Alcar

7. Branigen

8. Carnitine, Acetyl

9. Levocarnitine Acetyl

10. Medosan

2.3.2 Depositor-Supplied Synonyms

1. 5080-50-2

2. O-acetyl-l-carnitine Hcl

3. O-acetyl-l-carnitine Hydrochloride

4. Acetylcarnitine Chloride

5. Acetylcarnitine Hydrochloride

6. Nicetile

7. (r)-3-acetoxy-4-(trimethylammonio)butyrate Hydrochloride

8. Ndw10mx58t

9. Acetylcarnitine Hydrochloride, L-

10. Acetyl-l-carnitine Chloride

11. Branigan

12. Branigen

13. Normobren

14. Zibren

15. Oristar Ach

16. Nsc-747431

17. O-acetylcarnitine

18. Levacecarnine Hydrochloride

19. Acetyl Carnitine Hcl

20. Mfcd00082230

21. Smr000875234

22. Acetyl L-carnitine Hydrochloride

23. St-200

24. Acetylcarnitine L-form Hcl

25. Unii-ndw10mx58t

26. Acetylcarnitine L-form Hydrochloride

27. R-(-)-2-acetyloxy-3-carboxy-n,n,n-trimethyl-1-propanaminium Chloride

28. Bmse000464

29. Mls001332367

30. Mls001332368

31. Chembl1321219

32. Acetyl-l-car-nitine Hydrochloride

33. Hms2233g09

34. Acetyl Carnitine Hcl [inci]

35. Act03195

36. Ac-004

37. Nsc747431

38. Akos005138019

39. Akos015963427

40. Ccg-266869

41. Nsc 747431

42. Acetylcarnitine Hydrochloride [mi]

43. As-11664

44. Acetyl-l-carnitine Hydrochloride, >/=99%

45. Acetylcarnitine Hydrochloride [mart.]

46. Acetylcarnitine Hydrochloride [who-dd]

47. 1-propanaminium,n,n-trimethyl-, Chloride, (2r)-

48. ( Inverted Exclamation Marka)-acetylcarnitine Chloride

49. [(2r)-2-acetoxy-3-carboxy-propyl]-trimethyl-ammonium

50. Q27295965

51. [(2r)-2-(acetyloxy)-3-carboxypropyl]trimethylazanium Chloride

52. O-acetyl-l-carnitine Hydrochloride, >=99% (titration), Powder

53. (3-carboxy-2-hydroxypropyl)trimethylammonium Acetate (ester) Chloride

54. 1-propanaminium, 2-(acetyloxy)-3-carboxy-n,n,n-trimethyl-, Chloride (1:1), (2r)-

55. 1-propanaminium, 2-(acetyloxy)-3-carboxy-n,n,n-trimethyl-, Chloride, (2r)- (1:1)

56. 1-propanaminium, 2-(acetyloxy)-3-carboxy-n,n,n-trimethyl-, Chloride, (r)-

57. Ammonium, (3-carboxy-2-hydroxypropyl)trimethyl-, Chloride, Acetate, (-)-

2.4 Create Date

2005-07-19

3 Chemical and Physical Properties

Molecular Formula	C₉H₁₈ClNO₄
Molecular Weight	239.69 g/mol
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	6
Exact Mass	239.0924357 g/mol
Monoisotopic Mass	239.0924357 g/mol
Topological Polar Surface Area	63.6 Å²
Heavy Atom Count	15
Formal Charge	0
Complexity	219
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	2

4 Pharmacology and Biochemistry

4.1 MeSH Pharmacological Classification

Nootropic Agents

Drugs used to specifically facilitate learning or memory, particularly to prevent the cognitive deficits associated with dementias. These drugs act by a variety of mechanisms. (See all compounds classified as Nootropic Agents.)

Vitamin B Complex

A group of water-soluble vitamins, some of which are COENZYMES. (See all compounds classified as Vitamin B Complex.)

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