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Table 2 Chemical compounds of Cymbopogon validis leaf

From: Phytomedical assessment of two Cymbopogon species found in Nkonkobe Municipality: toxicological effect on human Chang liver cell line

Peak number

Phyto-compounds

Rt (mins)

Area %

Library quality match (%)

Chemical formulas

1

Cyclopentanol, 3-methylene

3.26

0.01

70

C5H10O

2

2-Hexenal

3.33

0.03

92

C6H12O

3

Trans-7-methyl-3-octene

3.40

0.01

72

C9H18

4

4-Heptanone

3.46

0.02

87

C7H14O

5

2-Heptanone

3.58

0.06

74

C7H14O

6

2-Heptanol

3.64

0.06

83

C7H16O

7

3-Carene

3.93

0.19

94

C10H16

8

α-Pinene

4.01

0.37

96

C10H16

9

Camphene

4.15

0.68

97

C10H16

10

β-Phellandrene

4.32

0.03

94

C10H16

11

β-Myrcene

4.41

4.85

86

C10H16

12

Octanal

4.49

0.01

86

C8H16O

13

α-Phellandrene

4.57

0.03

64

C10H16

14

Allylidenecyclohexane

4.61

0.05

45

C9H14

15

4-Carene

4.67

0.01

98

C10H16

16

Santolina triene

4.78

4.60

86

C10H16

17

β-Ocimene

4.87

2.72

94

C10H16

18

4-Methy-1,5-Heptadiene

4.92

0.11

64

n/a

19

γ-Terpinene

5.00

0.02

97

C10H18O

20

Hexanethioic acid

5.07

2.53

91

C6H12OS

21

Ethyl 2-(5-methyl-5-vinyltetrahydrofuran-2-yl)propan-2-yl carbonate

5.13

1.44

91

n/a

22

Linalyl alcohol

5.37

18.9

92

C10H18O

23

4-chlorobenzoic acid, 4-hexadecyl ester

5.45

0.11

90

C23H37ClO2

24

2,4,6-Octatriene

5.54

0.65

97

C8H12

25

5-Tetradecen-3-yne

5.63

0.07

72

C14H24

26

Citronellal

5.72

0.77

96

C10H20O

27

3-Hexadecene

5.82

0.09

83

C16H32

28

Endo-Borneol

5.92

0.69

97

C10H18O

29

Terpinen-4-ol

5.99

0.08

96

C10H18O

30

α-Terpineol

6.07

0.59

87

C10H18O

31

Disparlure

6.20

0.03

64

C19H38O

32

Citronellol

6.26

1.47

98

C10H18O

33

2,6-Octadien-1-ol, 3,7-dimethylene

6.33

0.04

86

C10H16O

34

Citral

6.40

0.16

95

C10H16O

35

Geraniol

6.48

2.68

95

C10H18O

36

4-Undecanone

6.60

0.94

95

C11H22O

37

Trans-Geranylgeraniol

6.74

0.01

68

C20H34O

38

Bornyl acetate

6.78

0.06

99

C12H20O2

39

d-Nonalactone

6.85

0.05

38

C9H16O2

40

2-Methoxy-4-vinylphenol

6.95

0.03

38

C9H10O2

41

1-Ethynylcyclopentanol

7.05

0.01

64

C7H10O

42

2,6-Octadiene,2,6-dimethylene

7.14

0.99

97

C10H16

43

α-Cubebene

7.24

0.11

99

C15H24

44

Geranyl acetate

7.35

1.97

90

C12H20O2

45

Epizonarene

7.42

0.31

98

C15H24

46

Cyclohexane, 1-ethenyl-1-methyl-2,4-bis-1-methylethenyl.

7.54

1.26

99

n/a

47

Formic acid

7.65

0.04

55

CH2O2

48

Caryophyllene

7.79

0.64

98

C15H24

49

α-Cubebene

7.97

0.81

70

C15H24

50

Epi-Bicyclosesquiphellandrene

8.05

0.05

87

C15H24

51

γ-Muurolene

8.10

0.65

83

C15H24

52

α-Muurolene

8.14

1.66

99

C15H24

53

4-epi-cubedol

8.52

2.41

93

C15H26O

54

Nephthalene

8.31

0.96

96

C10H8

55

Cubedol

8.39

6.08

95

C15H26O

56

Di-epi-alpha-cedrene

8.47

0.57

87

n/a

57

Guaia-1,11-diene

8.56

2.05

46

C15H24

58

Epizonarene

8.61

0.22

81

C15H24

59

Cyclohexane

8.64

0.44

30

C6H12

60

Gleenol

8.77

0.54

97

C15H26O

61

2-Naphthalenemethanol

8.96

6.67

86

C11H10O

62

Longifolene

9.08

6.53

93

C15H24

63

Hinesol

9.19

2.14

93

C15H26O

64

Agarospirol

9.25

0.37

98

C15H26O

65

Alloaromadendrene

9.42

0.37

53

C15H24

66

Isolongifolene

9.53

0.46

38

C15H24

67

Ethyladamantane-1-carboxylate

9.70

0.19

38

C13H20O2

68

β-Humulene

9.77

0.12

44

C15H24

69

Isocaryophillene

9.87

0.12

56

C15H24

70

Ledol

10.0

0.05

51

C15H26O

71

Acetic acid

10.1

2.69

38

C2H4O2

72

α-Guaiene

10.2

0.03

52

C15H24

73

4-Fluorobenzoic acid

10.4

0.02

62

C7H5FO2

74

Octasiloxane

11.3

0.01

41

H6OSi2

75

2-Nonadecanone

12.2

0.01

64

C19H38O

76

Hexamethylene

13.2

0.01

43

C7H14

77

Arsenous acid

13.8

0.04

43

H3AsO3

78

Diethyl ether

14.2

0.05

38

C4H10O

79

3-hexenyl ester

14.6

0.02

38

C10H16

80

4- hexadecyl ester

14.8

0.11

43

C16H33

Total amount of compounds

87.03

Monoterpene hydrocarbon

16.74

Oxygenated monoterpenes

31.43

Sesquiterpene hydrocarbon

14.26

Oxygenated sesquiterpene

11.6

Oxygenated diterpene

0.01

Aldehydes

6.81

Fatty acids

2.78

Others

3.40