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ACTIVE PHARMA INGREDIENTS

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Chemistry

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Also known as: 542-44-9, Monopalmitin, 1-monopalmitin, 1-palmitoyl-rac-glycerol, 2,3-dihydroxypropyl hexadecanoate, 1-palmitoylglycerol

Molecular Formula

C₁₉H₃₈O₄

Molecular Weight

330.5 g/mol

InChI Key

QHZLMUACJMDIAE-UHFFFAOYSA-N

FDA UNII

U9H9OM3S75

1-Monopalmitin is a metabolite found in the aging mouse brain.

1 2D Structure

1-Palmitoylglycerol

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

2,3-dihydroxypropyl hexadecanoate

2.1.2 InChI

InChI=1S/C19H38O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-19(22)23-17-18(21)16-20/h18,20-21H,2-17H2,1H3

2.1.3 InChI Key

QHZLMUACJMDIAE-UHFFFAOYSA-N

2.1.4 Canonical SMILES

CCCCCCCCCCCCCCCC(=O)OCC(CO)O

2.2 Other Identifiers

2.2.1 UNII

U9H9OM3S75

2.3 Synonyms

2.3.1 MeSH Synonyms

1. 1-glyceryl Hexadecanoate

2. 1-monohexadecanoyl-rac-glycerol

3. 1-monohexadecanoylglycerol

4. 1-monopalmitin

5. Palmitoyl Glycerol

6. Palmitoyl Glycerol, (+,-)-isomer

7. Palmitoyl Glycerol, Hexadecanoic-1-(14)c-labeled Cpd, (r)-isomer

8. Rac-1(3)-palmitoyl Glycerol

2.3.2 Depositor-Supplied Synonyms

1. 542-44-9

2. Monopalmitin

3. 1-monopalmitin

4. 1-palmitoyl-rac-glycerol

5. 2,3-dihydroxypropyl Hexadecanoate

6. 1-palmitoylglycerol

7. 2,3-dihydroxypropyl Palmitate

8. Glycerol 1-monopalmitate

9. Glycerol 1-palmitate

10. Glycerol 3-palmitate

11. 1-monopalmitoylglycerol

12. Palmitin, 1-mono-

13. 19670-51-0

14. Dl-alpha-palmitin

15. Alpha-monopalmitin

16. Hexadecanoic Acid, 2,3-dihydroxypropyl Ester

17. 1-monohexadecanoyl-rac-glycerol

18. .alpha.-monopalmitin

19. L-alpha-palmitin

20. 26657-96-5

21. Glycerides, C16-22

22. 1-hexadecanoyl-rac-glycerol

23. Palmitic Acid .alpha.-monoglyceride

24. 1-glyceryl Monohexadecanoate

25. Glyceryl 1-palmitate

26. Palmitic Acid Alpha-monoglyceride

27. Glycerol Palmitate

28. 1-glycerol Hexadecanoate

29. Glyceryl Monopalmitate

30. Nsc 404240

31. Mg(16:0/0:0/0:0)[rac]

32. U9h9om3s75

33. Chebi:69081

34. Nsc404240

35. Nsc-404240

36. 68002-70-0

37. 1-palmitoyl-glycerol

38. Mg(16:0)

39. Monopalmitin-1-glyceride

40. 1-monohexadecanoylglycerol

41. Glycerol 1-monohexadecanoate

42. Rac-1-palmitoylglycerol

43. 3-palmitoyl-rac-glycerol

44. Rac-glycerol 1-palmitate

45. Hexadecanoic Acid, Monoester With 1,2,3-propanetriol

46. Unii-u9h9om3s75

47. (c16-c22)trialkyl Glyceride

48. Palmitin, 1-mono

49. (s)-2,3-dihydroxypropyl Palmitate

50. (1)-2,3-dihydroxypropyl Palmitate

51. Einecs 208-812-9

52. Einecs 243-218-3

53. Einecs 251-283-4

54. Einecs 268-083-8

55. D,l-alpha-palmitin

56. (+-)-2,3-dihydroxypropyl Palmitate

57. Glycerol Monopalmitate

58. 1-hexadecanoylglycerol

59. Rac-alpha-monopalmitin

60. Rac-glyceryl Palmitate

61. (+-)-2,3-dihydroxypropyl Hexadecanoate

62. 1-monopalmitate Glycerol

63. (+-)-alpha-monopalmitin

64. (+-)-glyceryl Palmitate

65. Dl-1-monopalmitin

66. (+/-)-1-monopalmitin

67. Glycerol .alpha.-palmitate

68. Rac-1-monopalmitoylglycerol

69. Ec 268-083-8

70. Glycerol Alpha-monopalmitate

71. Rac-glycerol 1-monopalmitate

72. Schembl74863

73. (+-)--glycerol 1-palmitate

74. (+-)-1-monopalmitoylglycerol

75. Dl-alpha-palmitin, >=99%

76. (+-)-glycerol 1-monopalmitate

77. Monopalmitin(chunks Or Pellets)

78. Chembl1078140

79. Chebi:75811

80. Dtxsid00891470

81. Rac-2,3-dihydroxypropyl Palmitate

82. (.+/-.)-1-hexadecanoylglycerol

83. Amy39945

84. Bcp30618

85. Mag 16:0

86. Lmgl01010001

87. Mfcd00042734

88. Rac-palmitic Acid Alpha-monoglyceride

89. Rac-2,3-dihydroxypropyl Hexadecanoate

90. Akos015902112

91. (+/-)-1-hexadecanoylglycerol

92. Ccg-214232

93. Sb48400

94. (+-)-palmitic Acid Alpha-monoglyceride

95. (+/-)-1-o-hexadecanoylglycerol

96. Hexadecanoic Acid,3-dihydroxypropyl Ester

97. Ncgc00186665-01

98. As-49753

99. (.+/-.)-2,3-dihydroxypropyl Hexadecanoate

100. Ft-0673487

101. Ft-0673489

102. Ft-0696902

103. Ft-0699567

104. G0083

105. L10008

106. P-1125

107. A870508

108. Sr-05000002594

109. J-012718

110. Sr-05000002594-1

111. Brd-a80928489-001-01-0

112. Q27887716

113. 1-monopalmitin;glyceryl Palmitate ;1-palmitoyl-rac-glycerol;1-palmitoylglycerol

2.4 Create Date

2005-03-26

3 Chemical and Physical Properties

Molecular Formula	C₁₉H₃₈O₄
Molecular Weight	330.5 g/mol
XLogP3	6.3
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	18
Exact Mass	330.27700969 g/mol
Monoisotopic Mass	330.27700969 g/mol
Topological Polar Surface Area	66.8 Å²
Heavy Atom Count	23
Formal Charge	0
Complexity	256
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently Bonded Unit Count	1