Trimyristin

Synopsis, Chemistry

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Also known as: 555-45-3, Glycerol trimyristate, Glyceryl trimyristate, Myristin, Propane-1,2,3-triyl tritetradecanoate, Tritetradecanoin

Molecular Formula

C₄₅H₈₆O₆

Molecular Weight

723.2 g/mol

InChI Key

DUXYWXYOBMKGIN-UHFFFAOYSA-N

FDA UNII

18L31PSR28

Trimyristin is a metabolite found in or produced by Saccharomyces cerevisiae.

1 2D Structure

Trimyristin

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

2,3-di(tetradecanoyloxy)propyl tetradecanoate

2.1.2 InChI

InChI=1S/C45H86O6/c1-4-7-10-13-16-19-22-25-28-31-34-37-43(46)49-40-42(51-45(48)39-36-33-30-27-24-21-18-15-12-9-6-3)41-50-44(47)38-35-32-29-26-23-20-17-14-11-8-5-2/h42H,4-41H2,1-3H3

2.1.3 InChI Key

DUXYWXYOBMKGIN-UHFFFAOYSA-N

2.1.4 Canonical SMILES

CCCCCCCCCCCCCC(=O)OCC(COC(=O)CCCCCCCCCCCCC)OC(=O)CCCCCCCCCCCCC

2.2 Other Identifiers

2.2.1 UNII

18L31PSR28

2.3 Synonyms

2.3.1 MeSH Synonyms

1. Glyceryl Trimyristate

2.3.2 Depositor-Supplied Synonyms

1. 555-45-3

2. Glycerol Trimyristate

3. Glyceryl Trimyristate

4. Myristin

5. Propane-1,2,3-triyl Tritetradecanoate

6. Tritetradecanoin

7. Dynasan 114

8. Trimyristoylglycerol

9. Myristic Acid Triglyceride

10. Tetradecanoic Acid, 1,2,3-propanetriyl Ester

11. Myristin, Tri-

12. 1,2,3-tritetradecanoylglycerol

13. Glycerol Tritetradecanoate

14. 1,2,3-propanetriol Tritetradecanoate

15. Vp 114

16. Myristic Triglyceride

17. Tracylglycerol(42:0)

18. 2,3-di(tetradecanoyloxy)propyl Tetradecanoate

19. Nsc 4062

20. Glyceryl Tritetradecanoate

21. Tg(42:0)

22. Tg(14:0/14:0/14:0)

23. 1,2,3-tri-myristoyl-glycerol

24. Tetradecanoic Acid, 1,1',1''-(1,2,3-propanetriyl) Ester

25. 1,2,3-tritetradecanoyl-glycerol

26. 18l31psr28

27. Nsc-4062

28. 1,2,3-tritetradecanoyl-sn-glycerol

29. Tag(42:0)

30. Tracylglycerol(14:0/14:0/14:0)

31. 2,3-bis(tetradecanoyloxy)propyl Myristate

32. Tag(14:0/14:0/14:0)

33. Tg 14:0/14:0/14:0

34. 1,2,3-tritetradecanoyl-rac-glycerol

35. Tri-myristin

36. Unii-18l31psr28

37. Einecs 209-099-7

38. Tritetradecanoylglycerol

39. Beta-trimyristin (mmm)

40. Ai3-18153

41. Trimyristin [ii]

42. Trimyristin [mi]

43. Myristin, Tri- (8ci)

44. Trimyristin [inci]

45. 1,2,3-trimyristoylglycerol

46. Glycerol Trimyristirate

47. Schembl112641

48. Glyceryl Trimyristate, >=99%

49. Chebi:77391

50. Nsc4062

51. Dtxsid701014651

52. Cdaa-256309

53. Hy-n2511

54. Lmgl03012616

55. Mfcd00036229

56. S9209

57. Zinc85591205

58. Akos015899781

59. Beta-1,2,3-tri-tetradecanoyl-glycerol

60. Ccg-270410

61. Ac-34679

62. As-63167

63. Tetradecanoic Acid,2,3-propanetriyl Ester

64. Cs-0022782

65. Ft-0626749

66. G0088

67. 1-myristoyl-2-myristoyl-3-myristoyl-glycerol

68. T-6800

69. Q304581

70. 1,3-bis(tetradecanoyloxy)propan-2-yl Tetradecanoate

71. 1-tetradecanoyl-2-tetradecanoyl-3-tetradecanoyl-glycerol

72. Trimyristin, European Pharmacopoeia (ep) Reference Standard

2.4 Create Date

2005-03-26

3 Chemical and Physical Properties

Molecular Formula	C₄₅H₈₆O₆
Molecular Weight	723.2 g/mol
XLogP3	18.7
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	6
Rotatable Bond Count	44
Exact Mass	722.64244046 g/mol
Monoisotopic Mass	722.64244046 g/mol
Topological Polar Surface Area	78.9 Å²
Heavy Atom Count	51
Formal Charge	0
Complexity	711
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