Table 2 Levels of silylated primary metabolites in Melilotus, Trifolium, Medicago, and Ononis seed species.
Peak no | Average Rt (min) | KI | Name | MA | MO | MS | TP | TI | TM | TA | MDS | MDO | ML | MX | OR | ON | OS | OA |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Alcohols | ||||||||||||||||||
1 | 5.27 | 988.2 | Ethylene glycol, (2TMS) | 0.55 ± 0.03 | 0.51 ± 0.03 | 0.51 ± 0.02 | 0.58 ± 0.03 | 0.64 ± 0.05 | 0.51 ± 0.01 | 0.52 ± 0.01 | 0.56 ± 0.02 | 0.60 ± 0.02 | 0.50 ± 0.01 | 0.55 ± 0.04 | 0.48 ± 0.02 | 0.50 ± 0.02 | 0.60 ± 0.19 | 0.74 ± 0.05 |
2 | 6.56 | 1058.6 | 1,3 Propanediol, (2TMS) | 0.11 ± 0.01 | 0.10 ± 0.01 | 0.10 ± 0.00 | 0.11 ± 0.01 | 0.14 ± 0.01 | 0.10 ± 0.01 | 0.10 ± 0.00 | 0.07 ± 0.02 | 0.12 ± 0.02 | 0.09 ± 0.01 | 0.11 ± 0.00 | 0.10 ± 0.01 | 0.11 ± 0.01 | 0.13 ± 0.03 | 0.16 ± 0.01 |
3 | 10.33 | 1281.7 | Glycerol, (3TMS) | 3.78 ± 1.69 | 1.48 ± 0.82 | 1.97 ± 0.38 | 3.69 ± 0.42 | 4.80 ± 1.64 | 2.61 ± 2.77 | 1.47 ± 0.64 | 3.98 ± 1.79 | 4.56 ± 1.39 | 1.39 ± 0.19 | 5.71 ± 3.29 | 7.36 ± 2.32 | 3.02 ± 0.33 | 9.04 ± 3.05 | 7.44 ± 1.98 |
4 | 11.50 | 1357.8 | 1-Decanol, O-TMS | 0.02 ± 0.01 | 0.03 ± 0.01 | 0.03 ± 0.00 | 0.03 ± 0.01 | 0.04 ± 0.00 | 0.02 ± 0.00 | 0.03 ± 0.01 | 0.03 ± 0.01 | 0.03 ± 0.02 | 0.02 ± 0.00 | 0.02 ± 0.00 | 0.02 ± 0.00 | 0.02 ± 0.00 | 0.03 ± 0.01 | 0.04 ± 0.00 |
5 | 14.51 | 1578.6 | Alpha-hydroxyglutaric acid (3TMS) | 0.01 ± 0.00 | 0.00 ± 0.00 | 0.00 ± 0.00 | 0.01 ± 0.00 | 0.01 ± 0.00 | 0.00 ± 0.00 | 0.00 ± 0.00 | 0.01 ± 0.00 | 0.02 ± 0.00 | 0.00 ± 0.00 | 0.01 ± 0.00 | 0.01 ± 0.00 | 0.01 ± 0.00 | 0.01 ± 0.00 | 0.01 ± 0.00 |
6 | 20.70 | 2144.5 | 1-Octadecanol, O-TMS | 0.03 ± 0.00 | 0.03 ± 0.00 | 0.03 ± 0.00 | 0.05 ± 0.02 | 0.04 ± 0.00 | 0.03 ± 0.01 | 0.03 ± 0.00 | 0.07 ± 0.04 | 0.03 ± 0.00 | 0.04 ± 0.00 | 0.04 ± 0.00 | 0.04 ± 0.01 | 0.07 ± 0.05 | 0.06 ± 0.02 | 0.05 ± 0.00 |
7 | 21.20 | 2196.5 | 1-Hexadecanol, DMTBS | 0.01 ± 0.00 | 0.00 ± 0.00 | 0.01 ± 0.00 | 0.01 ± 0.00 | 0.02 ± 0.03 | 0.01 ± 0.01 | 0.01 ± 0.01 | 0.01 ± 0.00 | 0.01 ± 0.00 | 0.01 ± 0.00 | 0.01 ± 0.00 | 0.01 ± 0.00 | 0.01 ± 0.00 | 0.02 ± 0.02 | 0.02 ± 0.00 |
Total alcohols | 4.51 | 2.15 | 2.63 | 4.48 | 5.70 | 3.28 | 2.17 | 4.72 | 5.37 | 2.05 | 6.45 | 8.02 | 3.74 | 9.90 | 8.46 | |||
Amino acids | ||||||||||||||||||
8 | 7.11 | 1088.8 | Valine, TMS | 0.16 ± 0.23 | 0.01 ± 0.00 | 0.01 ± 0.01 | 0.07 ± 0.03 | 0.03 ± 0.02 | 0.02 ± 0.03 | 0.02 ± 0.01 | 0.01 ± 0.01 | 0.03 ± 0.02 | 0.02 ± 0.00 | 0.08 ± 0.08 | 0.06 ± 0.00 | 0.03 ± 0.02 | 0.06 ± 0.02 | 0.09 ± 0.01 |
9 | 7.43 | 1106.1 | Alanine, (2TMS) | 0.23 ± 0.37 | 0.01 ± 0.00 | 0.01 ± 0.00 | 0.14 ± 0.08 | 0.10 ± 0.10 | 0.03 ± 0.05 | 0.01 ± 0.00 | 0.02 ± 0.01 | 0.06 ± 0.04 | 0.01 ± 0.00 | 0.12 ± 0.09 | 0.19 ± 0.12 | 0.03 ± 0.04 | 0.12 ± 0.04 | 0.18 ± 0.03 |
10 | 8.51 | 1166.6 | 1-Methylproline | 0.04 ± 0.01 | 0.02 ± 0.00 | 0.01 ± 0.00 | 0.04 ± 0.01 | 0.08 ± 0.10 | 0.03 ± 0.01 | 0.02 ± 0.00 | 0.10 ± 0.07 | 0.96 ± 0.57 | 0.06 ± 0.02 | 0.76 ± 0.41 | 0.03 ± 0.01 | 0.03 ± 0.01 | 0.04 ± 0.00 | 0.03 ± 0.01 |
11 | 8.66 | 1175.4 | Isoleucine, TMS | 0.07 ± 0.10 | 0.01 ± 0.00 | 0.01 ± 0.00 | 0.03 ± 0.01 | 0.01 ± 0.00 | 0.01 ± 0.01 | 0.01 ± 0.00 | 0.01 ± 0.01 | 0.01 ± 0.01 | 0.01 ± 0.01 | 0.03 ± 0.02 | 0.02 ± 0.00 | 0.01 ± 0.00 | 0.03 ± 0.02 | 0.04 ± 0.01 |
12 | 9.37 | 1217.4 | Valine, (2TMS) | 0.17 ± 0.22 | 0.00 ± 0.00 | 0.01 ± 0.01 | 0.13 ± 0.07 | 0.06 ± 0.05 | 0.03 ± 0.04 | 0.01 ± 0.01 | 0.03 ± 0.03 | 0.03 ± 0.03 | 0.02 ± 0.00 | 0.06 ± 0.06 | 0.09 ± 0.04 | 0.03 ± 0.02 | 0.08 ± 0.00 | 0.14 ± 0.02 |
13 | 10.01 | 1260.5 | Serine, (2TMS) | 0.02 ± 0.02 | 0.02 ± 0.02 | 0.03 ± 0.01 | 0.02 ± 0.01 | 0.03 ± 0.02 | 0.05 ± 0.02 | 0.02 ± 0.02 | 0.42 ± 0.37 | 0.48 ± 0.36 | 0.76 ± 0.09 | 0.30 ± 0.10 | 0.04 ± 0.01 | 0.04 ± 0.01 | 0.06 ± 0.03 | 0.06 ± 0.03 |
14 | 10.26 | 1276.5 | Leucine, (2TMS) | 0.19 ± 0.27 | 0.00 ± 0.00 | 0.01 ± 0.00 | 0.06 ± 0.02 | 0.04 ± 0.01 | 0.02 ± 0.04 | 0.01 ± 0.01 | 0.02 ± 0.03 | 0.03 ± 0.01 | 0.02 ± 0.00 | 0.06 ± 0.07 | 0.09 ± 0.04 | 0.03 ± 0.01 | 0.07 ± 0.01 | 0.12 ± 0.01 |
15 | 10.77 | 1299.3 | l-Threonine, (2TMS) | 3.66 ± 0.27 | 3.65 ± 0.22 | 3.57 ± 0.07 | 4.04 ± 0.19 | 4.95 ± 0.32 | 3.42 ± 0.08 | 3.42 ± 0.15 | 4.32 ± 0.23 | 4.49 ± 0.13 | 3.36 ± 0.04 | 3.73 ± 0.26 | 3.49 ± 0.20 | 3.62 ± 0.19 | 4.36 ± 0.63 | 5.24 ± 0.05 |
16 | 12.03 | 1392 | Homoserine, (3TMS) | 0.04 ± 0.03 | 0.01 ± 0.00 | 0.01 ± 0.01 | 0.04 ± 0.01 | 0.04 ± 0.02 | 0.01 ± 0.01 | 0.01 ± 0.00 | 0.01 ± 0.01 | 0.02 ± 0.01 | 0.01 ± 0.00 | 0.03 ± 0.02 | 0.03 ± 0.01 | 0.01 ± 0.00 | 0.02 ± 0.00 | 0.04 ± 0.01 |
17 | 12.11 | 1398 | Glycine, (3TMS) | 1.73 ± 0.23 | 1.62 ± 0.13 | 1.73 ± 0.09 | 2.23 ± 0.19 | 2.87 ± 0.20 | 1.41 ± 0.33 | 1.23 ± 0.20 | 1.64 ± 1.24 | 2.41 ± 0.06 | 1.45 ± 0.11 | 1.81 ± 0.11 | 1.89 ± 0.05 | 1.93 ± 0.14 | 2.59 ± 0.65 | 3.25 ± 0.07 |
18 | 12.47 | 1425.2 | Aspartic acid, (2TMS) | 0.01 ± 0.01 | 0.01 ± 0.01 | 0.01 ± 0.00 | 0.07 ± 0.04 | 0.06 ± 0.04 | 0.01 ± 0.02 | 0.01 ± 0.01 | 0.01 ± 0.00 | 0.03 ± 0.03 | 0.01 ± 0.00 | 0.07 ± 0.03 | 0.17 ± 0.21 | 0.03 ± 0.03 | 0.11 ± 0.10 | 0.04 ± 0.02 |
19 | 12.88 | 1455.9 | Cysteine, 3(TMS) | 0.06 ± 0.05 | 0.01 ± 0.00 | 0.01 ± 0.00 | 1.87 ± 1.35 | 0.05 ± 0.04 | 0.14 ± 0.24 | 0.02 ± 0.01 | 0.09 ± 0.07 | 0.07 ± 0.03 | 0.16 ± 0.06 | 1.11 ± 0.85 | 0.15 ± 0.08 | 0.11 ± 0.09 | 0.18 ± 0.04 | 0.33 ± 0.10 |
20 | 13.83 | 1527.6 | l-Aspartic acid, (3TMS)- | 0.03 ± 0.03 | 0.01 ± 0.00 | 0.03 ± 0.01 | 0.18 ± 0.09 | 0.28 ± 0.18 | 0.06 ± 0.09 | 0.02 ± 0.01 | 0.03 ± 0.02 | 0.13 ± 0.13 | 0.05 ± 0.01 | 0.17 ± 0.05 | 0.72 ± 0.89 | 0.16 ± 0.15 | 0.38 ± 0.21 | 0.17 ± 0.09 |
21 | 13.86 | 1529.7 | Pyroglutamic acid, (N,O-TMS) | 0.78 ± 0.46 | 0.26 ± 0.12 | 0.56 ± 0.07 | 0.99 ± 0.23 | 1.92 ± 0.97 | 0.32 ± 0.28 | 0.38 ± 0.25 | 0.58 ± 0.46 | 1.15 ± 0.12 | 0.35 ± 0.09 | 1.34 ± 0.85 | 1.26 ± 0.17 | 0.71 ± 0.39 | 1.17 ± 0.31 | 1.49 ± 0.20 |
22 | 15.07 | 1623.6 | Glutamic acid (3TMS) | 0.03 ± 0.02 | 0.01 ± 0.00 | 0.01 ± 0.00 | 0.19 ± 0.11 | 0.25 ± 0.25 | 0.05 ± 0.07 | 0.01 ± 0.01 | 0.02 ± 0.01 | 0.22 ± 0.10 | 0.04 ± 0.00 | 0.16 ± 0.09 | 0.36 ± 0.05 | 0.19 ± 0.14 | 0.23 ± 0.06 | 0.52 ± 0.22 |
23 | 15.19 | 1633.2 | Phenylalanine (2TMS) | 0.04 ± 0.06 | 0.01 ± 0.00 | 0.01 ± 0.00 | 0.06 ± 0.01 | 0.03 ± 0.01 | 0.03 ± 0.04 | 0.01 ± 0.00 | 0.01 ± 0.01 | 0.04 ± 0.02 | 0.02 ± 0.01 | 0.06 ± 0.06 | 0.06 ± 0.04 | 0.04 ± 0.03 | 0.06 ± 0.02 | 0.10 ± 0.03 |
24 | 18.70 | 1947.4 | Tyrosine, (3TMS) | 0.07 ± 0.08 | 0.01 ± 0.00 | 0.02 ± 0.00 | 0.09 ± 0.01 | 0.11 ± 0.05 | 0.03 ± 0.03 | 0.02 ± 0.01 | 0.06 ± 0.04 | 0.22 ± 0.10 | 0.05 ± 0.02 | 0.22 ± 0.25 | 0.07 ± 0.03 | 0.05 ± 0.02 | 0.09 ± 0.01 | 0.11 ± 0.01 |
Total amino acids | 7.33 | 5.66 | 6.05 | 10.22 | 10.89 | 5.68 | 5.22 | 7.38 | 10.39 | 6.39 | 10.11 | 8.71 | 7.03 | 9.64 | 11.96 | |||
Aromatic | ||||||||||||||||||
25 | 9.81 | 1246.6 | Benzoic acid, TMS | 0.07 ± 0.05 | 0.10 ± 0.06 | 0.06 ± 0.01 | 0.14 ± 0.05 | 0.32 ± 0.23 | 0.04 ± 0.00 | 0.11 ± 0.07 | 0.06 ± 0.02 | 0.11 ± 0.09 | 0.05 ± 0.00 | 0.08 ± 0.04 | 0.24 ± 0.03 | 0.13 ± 0.04 | 0.30 ± 0.02 | 0.21 ± 0.05 |
26 | 13.79 | 1524.8 | 4-methoxybenzoic acid (TMS) | 0.06 ± 0.01 | 0.06 ± 0.00 | 0.06 ± 0.00 | 0.08 ± 0.00 | 0.08 ± 0.02 | 0.05 ± 0.01 | 0.06 ± 0.01 | 0.08 ± 0.00 | 0.07 ± 0.01 | 0.05 ± 0.00 | 0.05 ± 0.01 | 0.06 ± 0.00 | 0.06 ± 0.01 | 0.06 ± 0.01 | 0.08 ± 0.01 |
27 | 15.13 | 1628.3 | p-Hydroxybenzoic acid (TMS) | 0.04 ± 0.01 | 0.02 ± 0.00 | 0.02 ± 0.01 | 0.05 ± 0.00 | 0.05 ± 0.02 | 0.03 ± 0.01 | 0.03 ± 0.00 | 0.03 ± 0.01 | 0.07 ± 0.01 | 0.04 ± 0.00 | 0.04 ± 0.01 | 0.03 ± 0.00 | 0.12 ± 0.04 | 0.03 ± 0.00 | 0.03 ± 0.00 |
28 | 18.67 | 1941.4 | p-Coumaric acid (2TMS) | 0.03 ± 0.01 | 0.01 ± 0.00 | 0.01 ± 0.00 | 0.02 ± 0.00 | 0.02 ± 0.00 | 0.02 ± 0.01 | 0.01 ± 0.00 | 0.02 ± 0.01 | 0.02 ± 0.00 | 0.02 ± 0.00 | 0.03 ± 0.01 | 0.02 ± 0.00 | 0.05 ± 0.01 | 0.02 ± 0.00 | 0.02 ± 0.00 |
Total aromatic | 0.21 | 0.19 | 0.15 | 0.28 | 0.47 | 0.14 | 0.21 | 0.19 | 0.27 | 0.15 | 0.21 | 0.34 | 0.36 | 0.41 | 0.34 | |||
Fatty acids/esters | ||||||||||||||||||
29 | 15.72 | 1647.1 | Lauric acid, TMS | 0.03 ± 0.04 | 0.01 ± 0.01 | 0.04 ± 0.01 | 0.26 ± 0.17 | 0.20 ± 0.08 | 0.09 ± 0.12 | 0.03 ± 0.01 | 0.07 ± 0.04 | 0.30 ± 0.18 | 0.07 ± 0.01 | 0.13 ± 0.04 | 0.91 ± 1.31 | 0.13 ± 0.08 | 0.25 ± 0.19 | 0.13 ± 0.01 |
30 | 17.60 | 1840.9 | Myristic acid, TMS | 0.68 ± 0.04 | 0.35 ± 0.04 | 0.36 ± 0.02 | 0.47 ± 0.03 | 0.59 ± 0.08 | 1.29 ± 0.05 | 1.16 ± 0.03 | 1.27 ± 0.25 | 0.81 ± 0.08 | 1.09 ± 0.03 | 1.07 ± 0.08 | 0.54 ± 0.02 | 0.64 ± 0.06 | 0.56 ± 0.17 | 0.63 ± 0.03 |
31 | 18.44 | 1919.1 | Palmitic acid, methyl ester | 0.05 ± 0.01 | 0.03 ± 0.02 | 0.02 ± 0.00 | 0.06 ± 0.00 | 0.06 ± 0.01 | 0.04 ± 0.02 | 0.04 ± 0.02 | 0.06 ± 0.01 | 0.06 ± 0.00 | 0.05 ± 0.00 | 0.06 ± 0.01 | 0.06 ± 0.01 | 0.09 ± 0.03 | 0.08 ± 0.02 | 0.09 ± 0.02 |
32 | 18.65 | 1939.3 | Pentadecanoic acid, TMS ester | 0.10 ± 0.02 | 0.08 ± 0.02 | 0.08 ± 0.00 | 0.13 ± 0.02 | 0.17 ± 0.07 | 0.08 ± 0.02 | 0.09 ± 0.02 | 0.27 ± 0.09 | 0.14 ± 0.03 | 0.10 ± 0.01 | 0.14 ± 0.05 | 0.13 ± 0.01 | 0.13 ± 0.04 | 0.16 ± 0.04 | 0.21 ± 0.02 |
33 | 19.65 | 2037.9 | Palmitic acid, TMS | 4.19 ± 1.16 | 1.90 ± 0.18 | 2.30 ± 0.27 | 4.04 ± 0.23 | 6.03 ± 1.17 | 5.63 ± 1.53 | 4.37 ± 0.67 | 5.32 ± 0.75 | 6.14 ± 0.84 | 4.50 ± 0.26 | 6.83 ± 1.69 | 6.81 ± 0.82 | 4.35 ± 0.86 | 10.51 ± 3.73 | 9.94 ± 0.76 |
34 | 20.60 | 2134 | Margaric acid, TMS | 0.12 ± 0.02 | 0.08 ± 0.00 | 0.09 ± 0.01 | 0.11 ± 0.01 | 0.15 ± 0.04 | 0.14 ± 0.00 | 0.12 ± 0.01 | 0.17 ± 0.00 | 0.14 ± 0.01 | 0.12 ± 0.01 | 0.14 ± 0.02 | 0.14 ± 0.02 | 0.13 ± 0.02 | 0.30 ± 0.22 | 0.19 ± 0.01 |
35 | 21.28 | 2204 | Oleic acid, TMS | 2.95 ± 2.18 | 0.63 ± 0.01 | 0.83 ± 0.15 | 3.82 ± 0.61 | 3.07 ± 0.60 | 10.02 ± 7.67 | 4.13 ± 0.96 | 2.44 ± 0.70 | 4.08 ± 2.20 | 4.38 ± 0.39 | 7.56 ± 2.63 | 9.86 ± 3.25 | 3.54 ± 1.90 | 27.29 ± 28.40 | 12.53 ± 1.57 |
36 | 21.246 | 2205.3 | Linoleic acid, TMS | 0.85 ± 0.91 | 0.04 ± 0.01 | 0.20 ± 0.12 | 1.07 ± 0.18 | 1.04 ± 0.24 | 1.83 ± 2.34 | 0.34 ± 0.17 | 0.19 ± 0.10 | 1.00 ± 0.84 | 0.39 ± 0.08 | 1.98 ± 0.90 | 3.47 ± 1.10 | 1.12 ± 0.51 | 3.35 ± 2.63 | 4.08 ± 0.30 |
37 | 21.342 | 2213 | α-Linolenic acid, TMS | 2.03 ± 1.98 | 0.12 ± 0.06 | 0.28 ± 0.11 | 0.52 ± 0.22 | 0.52 ± 0.17 | 0.88 ± 0.31 | 0.39 ± 0.12 | 0.55 ± 0.17 | 1.19 ± 0.78 | 0.51 ± 0.14 | 2.16 ± 0.62 | 3.09 ± 1.13 | 1.69 ± 0.91 | 3.42 ± 1.51 | 2.98 ± 0.44 |
38 | 21.52 | 2231.3 | Stearic acid, TMS | 2.66 ± 0.19 | 2.12 ± 0.14 | 2.09 ± 0.05 | 2.76 ± 0.05 | 4.18 ± 0.62 | 3.34 ± 0.69 | 2.61 ± 0.16 | 3.01 ± 0.41 | 2.87 ± 0.18 | 2.66 ± 0.08 | 3.01 ± 0.35 | 3.06 ± 0.48 | 2.51 ± 0.18 | 9.24 ± 9.01 | 3.81 ± 0.35 |
39 | 23.24 | 2426.2 | Arachidic acid, TMS | 0.19 ± 0.05 | 0.08 ± 0.01 | 0.09 ± 0.01 | 0.14 ± 0.02 | 0.39 ± 0.16 | 0.30 ± 0.05 | 0.20 ± 0.01 | 0.24 ± 0.09 | 0.28 ± 0.05 | 0.24 ± 0.03 | 0.29 ± 0.06 | 0.39 ± 0.12 | 0.18 ± 0.03 | 2.13 ± 2.73 | 0.31 ± 0.09 |
40 | 24.05 | 2529.4 | Heneicosanoic acid, TMS | 0.02 ± 0.01 | 0.01 ± 0.01 | 0.02 ± 0.01 | 0.03 ± 0.00 | 0.11 ± 0.10 | 0.06 ± 0.01 | 0.04 ± 0.01 | 0.04 ± 0.01 | 0.04 ± 0.00 | 0.03 ± 0.00 | 0.06 ± 0.01 | 0.10 ± 0.00 | 0.05 ± 0.01 | 0.33 ± 0.39 | 0.12 ± 0.10 |
41 | 24.50 | 2587.1 | 1-Monopalmitin, TMS | 1.59 ± 0.50 | 0.68 ± 0.47 | 0.45 ± 0.07 | 0.76 ± 0.12 | 0.92 ± 0.24 | 0.48 ± 0.15 | 0.48 ± 0.14 | 0.79 ± 0.14 | 1.00 ± 0.17 | 0.50 ± 0.03 | 0.66 ± 0.16 | 0.82 ± 0.08 | 0.59 ± 0.13 | 3.97 ± 5.04 | 1.37 ± 0.37 |
42 | 24.84 | 2629.9 | Behenic acid, TMS | 0.12 ± 0.01 | 0.05 ± 0.00 | 0.06 ± 0.01 | 0.12 ± 0.03 | 0.39 ± 0.18 | 0.19 ± 0.04 | 0.14 ± 0.02 | 0.17 ± 0.08 | 0.22 ± 0.04 | 0.17 ± 0.02 | 0.26 ± 0.08 | 0.37 ± 0.07 | 0.17 ± 0.03 | 1.70 ± 2.27 | 0.30 ± 0.08 |
43 | 26.32 | 2813.9 | Lignoceric acid, TMS | 0.09 ± 0.01 | 0.04 ± 0.01 | 0.04 ± 0.00 | 0.07 ± 0.01 | 0.11 ± 0.05 | 0.13 ± 0.01 | 0.12 ± 0.01 | 0.12 ± 0.04 | 0.12 ± 0.02 | 0.11 ± 0.01 | 0.12 ± 0.02 | 0.08 ± 0.01 | 0.09 ± 0.01 | 0.92 ± 1.39 | 0.15 ± 0.02 |
Total fatty acids/esters | 15.67 | 6.24 | 6.96 | 14.36 | 17.92 | 24.51 | 14.25 | 14.72 | 18.40 | 14.93 | 24.46 | 29.84 | 15.40 | 64.20 | 36.83 | |||
Nitrogenous compounds | ||||||||||||||||||
44 | 10.54 | 1294.8 | Nicotinic acid, TMS | 0.05 ± 0.01 | 0.02 ± 0.00 | 0.22 ± 0.16 | 0.94 ± 0.36 | 1.51 ± 0.67 | 0.06 ± 0.06 | 0.05 ± 0.01 | 0.08 ± 0.07 | 0.09 ± 0.03 | 0.17 ± 0.04 | 0.15 ± 0.06 | 0.26 ± 0.06 | 0.17 ± 0.08 | 0.48 ± 0.10 | 0.66 ± 0.17 |
45 | 15.14 | 1629 | Triethanolamine, (3TMS) | 0.11 ± 0.10 | 0.15 ± 0.15 | 0.11 ± 0.04 | 0.10 ± 0.04 | 0.14 ± 0.08 | 0.02 ± 0.01 | 0.05 ± 0.04 | 0.15 ± 0.12 | 0.08 ± 0.06 | 0.04 ± 0.02 | 0.05 ± 0.04 | 0.04 ± 0.02 | 0.05 ± 0.01 | 0.04 ± 0.02 | 0.05 ± 0.02 |
46 | 23.19 | 2420.2 | Uridine, (3 O-TMS) | 0.01 ± 0.01 | 0.01 ± 0.00 | 0.01 ± 0.02 | 0.02 ± 0.01 | 0.04 ± 0.03 | 0.04 ± 0.04 | 0.02 ± 0.02 | 0.03 ± 0.03 | 0.03 ± 0.01 | 0.01 ± 0.00 | 0.03 ± 0.01 | 0.02 ± 0.00 | 0.01 ± 0.01 | 0.03 ± 0.02 | 0.06 ± 0.00 |
47 | 23.58 | 2468.8 | Uridine, (3 O-TMS) | 0.04 ± 0.03 | 0.01 ± 0.00 | 0.01 ± 0.01 | 0.13 ± 0.03 | 0.20 ± 0.16 | 0.06 ± 0.06 | 0.02 ± 0.01 | 0.01 ± 0.00 | 0.07 ± 0.01 | 0.04 ± 0.00 | 0.07 ± 0.01 | 0.12 ± 0.02 | 0.09 ± 0.05 | 0.21 ± 0.09 | 0.27 ± 0.04 |
Total nitrogenous compounds | 0.21 | 0.19 | 0.36 | 1.19 | 1.90 | 0.18 | 0.14 | 0.28 | 0.27 | 0.26 | 0.30 | 0.44 | 0.32 | 0.77 | 1.04 | |||
Organic acids | ||||||||||||||||||
48 | 5.56 | 1004.1 | Lactic acid, (2TMS) | 0.04 ± 0.00 | 0.04 ± 0.00 | 0.04 ± 0.00 | 0.05 ± 0.01 | 0.05 ± 0.00 | 0.04 ± 0.00 | 0.04 ± 0.00 | 0.05 ± 0.00 | 0.04 ± 0.00 | 0.04 ± 0.00 | 0.04 ± 0.00 | 0.04 ± 0.00 | 0.04 ± 0.00 | 0.05 ± 0.01 | 0.06 ± 0.01 |
49 | 6.38 | 1048.6 | Glycolic acid, (2TMS) | 0.05 ± 0.01 | 0.05 ± 0.00 | 0.05 ± 0.00 | 0.06 ± 0.00 | 0.07 ± 0.01 | 0.05 ± 0.00 | 0.05 ± 0.00 | 0.06 ± 0.01 | 0.06 ± 0.00 | 0.05 ± 0.01 | 0.06 ± 0.00 | 0.05 ± 0.00 | 0.05 ± 0.01 | 0.07 ± 0.01 | 0.08 ± 0.00 |
50 | 6.69 | 1065.9 | Lactic acid, (2TMS) | 2.11 ± 1.00 | 2.45 ± 1.24 | 3.00 ± 0.71 | 2.82 ± 0.31 | 2.93 ± 0.62 | 1.16 ± 0.60 | 2.61 ± 1.88 | 2.45 ± 1.40 | 2.97 ± 0.47 | 1.91 ± 0.41 | 2.58 ± 1.70 | 1.88 ± 0.71 | 1.37 ± 0.43 | 1.43 ± 0.29 | 1.97 ± 0.87 |
51 | 6.83 | 1073.1 | Caproic acid (TMS) | 0.02 ± 0.00 | 0.02 ± 0.00 | 0.02 ± 0.00 | 0.04 ± 0.00 | 0.02 ± 0.01 | 0.03 ± 0.01 | 0.02 ± 0.00 | 0.04 ± 0.02 | 0.03 ± 0.01 | 0.03 ± 0.01 | 0.03 ± 0.01 | 0.04 ± 0.01 | 0.03 ± 0.01 | 0.06 ± 0.03 | 0.05 ± 0.01 |
52 | 6.95 | 1079.7 | Glycolic acid, (2TMS) | 0.14 ± 0.02 | 0.11 ± 0.03 | 0.11 ± 0.02 | 0.16 ± 0.02 | 0.22 ± 0.03 | 0.09 ± 0.01 | 0.12 ± 0.01 | 0.19 ± 0.06 | 0.20 ± 0.01 | 0.14 ± 0.02 | 0.13 ± 0.04 | 0.14 ± 0.03 | 0.12 ± 0.02 | 0.16 ± 0.04 | 0.18 ± 0.02 |
53 | 7.16 | 1091.4 | Pyruvic acid, (2TMS) | 0.04 ± 0.02 | 0.02 ± 0.00 | 0.02 ± 0.00 | 0.03 ± 0.00 | 0.04 ± 0.01 | 0.02 ± 0.00 | 0.02 ± 0.00 | 0.08 ± 0.02 | 0.04 ± 0.02 | 0.03 ± 0.01 | 0.03 ± 0.00 | 0.03 ± 0.01 | 0.03 ± 0.00 | 0.04 ± 0.01 | 0.04 ± 0.00 |
54 | 8.14 | 1146.1 | β-Lactic acid, (2TMS) | 0.11 ± 0.06 | 0.08 ± 0.02 | 0.06 ± 0.01 | 0.12 ± 0.02 | 0.13 ± 0.02 | 0.05 ± 0.01 | 0.08 ± 0.01 | 0.09 ± 0.01 | 0.11 ± 0.04 | 0.07 ± 0.01 | 0.08 ± 0.02 | 0.08 ± 0.03 | 0.06 ± 0.01 | 0.09 ± 0.01 | 0.10 ± 0.01 |
55 | 8.37 | 1162 | Malonic acid, (2TMS) | 0.04 ± 0.03 | 0.02 ± 0.00 | 0.02 ± 0.00 | 0.03 ± 0.00 | 0.01 ± 0.01 | 0.01 ± 0.01 | 0.02 ± 0.00 | 0.13 ± 0.14 | 0.03 ± 0.01 | 0.02 ± 0.01 | 0.01 ± 0.01 | 0.01 ± 0.01 | 0.01 ± 0.01 | 0.02 ± 0.01 | 0.02 ± 0.01 |
56 | 8.52 | 1167.4 | 2-Hydroxyvaleric acid, (2TMS) | 0.01 ± 0.00 | 0.01 ± 0.00 | 0.01 ± 0.00 | 0.01 ± 0.00 | 0.01 ± 0.00 | 0.01 ± 0.00 | 0.01 ± 0.00 | 0.01 ± 0.00 | 0.01 ± 0.00 | 0.01 ± 0.00 | 0.01 ± 0.00 | 0.04 ± 0.00 | 0.01 ± 0.00 | 0.05 ± 0.02 | 0.03 ± 0.01 |
57 | 9.17 | 1204.4 | Malonic acid, (2TMS) | 0.01 ± 0.01 | 0.01 ± 0.01 | 0.01 ± 0.01 | 0.01 ± 0.00 | 0.01 ± 0.01 | 0.01 ± 0.00 | 0.01 ± 0.00 | 0.01 ± 0.00 | 0.01 ± 0.01 | 0.01 ± 0.00 | 0.03 ± 0.01 | 0.03 ± 0.01 | 0.03 ± 0.02 | 0.04 ± 0.03 | 0.03 ± 0.02 |
58 | 9.64 | 1235.6 | γ-Hydroxybutyric acid, (2TMS) | 1.02 ± 0.09 | 1.10 ± 0.20 | 0.95 ± 0.03 | 1.26 ± 0.26 | 1.40 ± 0.30 | 0.70 ± 0.04 | 0.76 ± 0.06 | 0.99 ± 0.11 | 1.09 ± 0.04 | 0.75 ± 0.01 | 0.94 ± 0.12 | 0.84 ± 0.04 | 1.02 ± 0.13 | 1.28 ± 0.48 | 1.36 ± 0.09 |
59 | 10.04 | 1261.9 | Octanoic acid, TMS ester | 0.02 ± 0.02 | 0.04 ± 0.01 | 0.03 ± 0.00 | 0.03 ± 0.00 | 0.04 ± 0.01 | 0.03 ± 0.00 | 0.03 ± 0.01 | 0.04 ± 0.01 | 0.04 ± 0.01 | 0.03 ± 0.00 | 0.02 ± 0.01 | 0.03 ± 0.00 | 0.03 ± 0.00 | 0.05 ± 0.01 | 0.05 ± 0.00 |
60 | 10.86 | 1315.6 | Succinic acid, (2TMS) | 0.34 ± 0.03 | 0.28 ± 0.03 | 0.28 ± 0.00 | 0.42 ± 0.05 | 0.48 ± 0.03 | 0.27 ± 0.02 | 0.28 ± 0.02 | 0.38 ± 0.02 | 0.44 ± 0.01 | 0.30 ± 0.01 | 0.34 ± 0.05 | 0.32 ± 0.02 | 0.31 ± 0.05 | 0.43 ± 0.05 | 0.50 ± 0.01 |
61 | 11.21 | 1338.3 | Glyceric acid, (3TMS) | 0.42 ± 0.10 | 0.37 ± 0.02 | 0.37 ± 0.00 | 0.45 ± 0.01 | 0.54 ± 0.03 | 0.32 ± 0.01 | 0.32 ± 0.02 | 0.45 ± 0.08 | 0.49 ± 0.04 | 0.34 ± 0.02 | 0.38 ± 0.03 | 0.37 ± 0.03 | 0.38 ± 0.04 | 0.47 ± 0.06 | 0.59 ± 0.01 |
62 | 11.35 | 1346.9 | Fumaric acid, (2TMS) | 0.01 ± 0.01 | 0.00 ± 0.00 | 0.01 ± 0.01 | 0.02 ± 0.00 | 0.02 ± 0.00 | 0.01 ± 0.01 | 0.00 ± 0.00 | 0.03 ± 0.02 | 0.05 ± 0.01 | 0.03 ± 0.01 | 0.03 ± 0.01 | 0.07 ± 0.01 | 0.04 ± 0.02 | 0.08 ± 0.01 | 0.07 ± 0.01 |
63 | 11.52 | 1366.8 | Succinic acid, (2TMS) | 0.11 ± 0.03 | 0.10 ± 0.02 | 0.09 ± 0.00 | 0.35 ± 0.23 | 0.16 ± 0.01 | 0.09 ± 0.02 | 0.11 ± 0.02 | 0.11 ± 0.02 | 0.13 ± 0.07 | 0.06 ± 0.00 | 0.28 ± 0.17 | 0.16 ± 0.04 | 0.08 ± 0.02 | 0.14 ± 0.03 | 0.10 ± 0.02 |
64 | 13.41 | 1496.1 | Malonic acid, (2TMS) | 0.08 ± 0.05 | 0.04 ± 0.00 | 0.05 ± 0.01 | 0.10 ± 0.02 | 0.19 ± 0.06 | 0.05 ± 0.01 | 0.05 ± 0.01 | 0.07 ± 0.03 | 0.31 ± 0.09 | 0.20 ± 0.05 | 0.13 ± 0.01 | 0.16 ± 0.08 | 0.12 ± 0.06 | 0.43 ± 0.24 | 0.13 ± 0.04 |
Total organic acids | 4.57 | 4.74 | 5.13 | 5.96 | 6.34 | 2.92 | 4.53 | 5.17 | 6.05 | 4.01 | 5.11 | 4.30 | 3.72 | 4.87 | 5.35 | |||
Sugar alcohols | ||||||||||||||||||
65 | 13.74 | 1520.3 | Erythritol, (4TMS) | 0.01 ± 0.00 | 0.01 ± 0.01 | 0.01 ± 0.00 | 0.01 ± 0.00 | 0.05 ± 0.06 | 0.00 ± 0.00 | 0.01 ± 0.00 | 0.01 ± 0.00 | 0.01 ± 0.00 | 0.01 ± 0.00 | 0.01 ± 0.01 | 0.01 ± 0.00 | 0.01 ± 0.00 | 0.02 ± 0.00 | 0.02 ± 0.00 |
66 | 14.43 | 1572.4 | Threonic acid, (3TMS) | 0.01 ± 0.00 | 0.01 ± 0.01 | 0.02 ± 0.01 | 0.11 ± 0.03 | 0.19 ± 0.11 | 0.04 ± 0.04 | 0.02 ± 0.02 | 0.03 ± 0.01 | 0.14 ± 0.07 | 0.15 ± 0.04 | 0.10 ± 0.02 | 0.23 ± 0.11 | 0.06 ± 0.04 | 0.20 ± 0.05 | 0.23 ± 0.08 |
67 | 15.35 | 1641.2 | Xylonic acid, 1,5-lactone, (3TMS) | 0.22 ± 0.00 | 0.10 ± 0.01 | 0.10 ± 0.01 | 0.12 ± 0.02 | 0.16 ± 0.00 | 0.47 ± 0.02 | 0.43 ± 0.01 | 0.41 ± 0.19 | 0.26 ± 0.01 | 0.39 ± 0.01 | 0.37 ± 0.03 | 0.18 ± 0.02 | 0.20 ± 0.02 | 0.17 ± 0.02 | 0.19 ± 0.02 |
68 | 15.85 | 1677.7 | Arabino-Hexonic acid, 3-deoxy-O-(3TMS)lactone | 0.98 ± 0.83 | 0.02 ± 0.00 | 0.02 ± 0.00 | 0.03 ± 0.01 | 0.02 ± 0.01 | 0.01 ± 0.01 | 0.05 ± 0.06 | 0.02 ± 0.00 | 0.04 ± 0.01 | 0.02 ± 0.00 | 0.02 ± 0.00 | 0.05 ± 0.01 | 0.04 ± 0.02 | 0.06 ± 0.01 | 0.05 ± 0.03 |
69 | 16.14 | 1713.3 | Xylitol, (5TMS) | 0.00 ± 0.00 | 0.00 ± 0.00 | 0.00 ± 0.00 | 0.01 ± 0.00 | 0.01 ± 0.00 | 0.00 ± 0.00 | 0.00 ± 0.00 | 0.00 ± 0.00 | 0.01 ± 0.00 | 0.00 ± 0.00 | 0.01 ± 0.00 | 0.01 ± 0.00 | 0.01 ± 0.00 | 0.01 ± 0.01 | 0.01 ± 0.00 |
70 | 17.07 | 1791.6 | Fucitol, (5TMS) | 0.20 ± 0.07 | 0.09 ± 0.01 | 0.09 ± 0.01 | 0.15 ± 0.01 | 0.26 ± 0.06 | 0.12 ± 0.04 | 0.07 ± 0.01 | 0.27 ± 0.01 | 0.22 ± 0.09 | 0.10 ± 0.03 | 0.14 ± 0.05 | 0.21 ± 0.02 | 0.13 ± 0.02 | 0.39 ± 0.20 | 0.42 ± 0.05 |
71 | 17.72 | 1853.1 | Pinitol, (5TMS) | 0.50 ± 0.36 | 0.04 ± 0.01 | 0.60 ± 0.22 | 1.05 ± 0.44 | 2.27 ± 2.21 | 0.38 ± 0.37 | 0.32 ± 0.13 | 0.27 ± 0.16 | 0.32 ± 0.08 | 0.17 ± 0.03 | 1.70 ± 1.25 | 5.36 ± 2.79 | 0.05 ± 0.00 | 5.13 ± 2.21 | 3.73 ± 0.02 |
72 | 17.85 | 1866.6 | 1,5-Anhydro-d-sorbitol, (4TMS) | 0.01 ± 0.00 | 0.01 ± 0.01 | 0.01 ± 0.00 | 0.02 ± 0.01 | 0.02 ± 0.01 | 0.01 ± 0.00 | 0.01 ± 0.00 | 0.02 ± 0.00 | 0.01 ± 0.01 | 0.00 ± 0.00 | 0.01 ± 0.01 | 0.04 ± 0.01 | 0.01 ± 0.01 | 0.03 ± 0.01 | 0.04 ± 0.00 |
73 | 18.26 | 1893 | Mannonic acid, 1,5-lactone, 4 (TMS) | 0.08 ± 0.09 | 0.01 ± 0.00 | 0.02 ± 0.01 | 0.09 ± 0.04 | 0.13 ± 0.11 | 0.03 ± 0.03 | 0.03 ± 0.02 | 0.08 ± 0.05 | 0.05 ± 0.01 | 0.03 ± 0.01 | 0.89 ± 0.84 | 0.17 ± 0.11 | 0.04 ± 0.03 | 0.20 ± 0.13 | 0.10 ± 0.05 |
74 | 18.78 | 1952 | Mannitol, (6TMS) | 0.02 ± 0.01 | 0.02 ± 0.01 | 0.01 ± 0.00 | 0.04 ± 0.00 | 0.86 ± 1.41 | 0.02 ± 0.02 | 0.05 ± 0.03 | 0.04 ± 0.01 | 0.03 ± 0.00 | 0.01 ± 0.01 | 0.14 ± 0.15 | 0.03 ± 0.01 | 0.01 ± 0.00 | 0.04 ± 0.01 | 0.04 ± 0.01 |
75 | 18.87 | 1959.7 | Sorbitol, (6TMS) | 0.44 ± 0.64 | 0.04 ± 0.06 | 0.04 ± 0.01 | 0.17 ± 0.05 | 0.31 ± 0.29 | 0.04 ± 0.04 | 0.04 ± 0.04 | 0.06 ± 0.02 | 0.10 ± 0.01 | 0.02 ± 0.00 | 2.16 ± 2.98 | 0.33 ± 0.29 | 0.04 ± 0.03 | 0.29 ± 0.12 | 0.13 ± 0.13 |
76 | 19.54 | 2025.7 | Gluconic acid, (6TMS) | 0.24 ± 0.24 | 0.09 ± 0.01 | 0.10 ± 0.01 | 0.25 ± 0.12 | 0.25 ± 0.22 | 0.08 ± 0.00 | 0.12 ± 0.05 | 0.12 ± 0.03 | 0.10 ± 0.06 | 0.10 ± 0.01 | 0.74 ± 0.95 | 0.19 ± 0.13 | 0.10 ± 0.03 | 1.85 ± 2.94 | 0.16 ± 0.09 |
77 | 20.08 | 2087.3 | Myo-Inositol, (5TMS) | 0.01 ± 0.00 | 0.01 ± 0.00 | 0.01 ± 0.00 | 0.01 ± 0.00 | 0.01 ± 0.01 | 0.01 ± 0.00 | 0.01 ± 0.00 | 0.03 ± 0.02 | 0.01 ± 0.00 | 0.02 ± 0.01 | 0.03 ± 0.00 | 0.01 ± 0.01 | 0.01 ± 0.01 | 0.27 ± 0.45 | 0.01 ± 0.00 |
78 | 20.41 | 2114.2 | Myo-Inositol, (6TMS) | 0.29 ± 0.20 | 0.03 ± 0.02 | 0.03 ± 0.02 | 0.33 ± 0.08 | 0.36 ± 0.19 | 0.11 ± 0.12 | 0.09 ± 0.05 | 0.27 ± 0.26 | 0.50 ± 0.04 | 0.16 ± 0.01 | 0.68 ± 0.30 | 0.17 ± 0.05 | 0.36 ± 0.19 | 0.28 ± 0.10 | 0.49 ± 0.21 |
Total sugar alcohols | 3.02 | 0.47 | 1.07 | 2.39 | 4.90 | 1.32 | 1.26 | 1.62 | 1.81 | 1.19 | 7.01 | 6.98 | 1.08 | 8.94 | 5.60 | |||
Sugars | ||||||||||||||||||
79 | 17.99 | 1878 | Glucose, (5TMS) | 0.00 ± 0.00 | 0.00 ± 0.00 | 0.00 ± 0.00 | 0.01 ± 0.00 | 0.01 ± 0.00 | 0.00 ± 0.00 | 0.00 ± 0.00 | 0.00 ± 0.00 | 0.01 ± 0.00 | 0.00 ± 0.00 | 0.01 ± 0.00 | 0.01 ± 0.00 | 0.00 ± 0.00 | 0.01 ± 0.00 | 0.01 ± 0.00 |
80 | 18.36 | 1916.9 | Mannopyranoside, methyl (4TMS) | 0.03 ± 0.00 | 0.02 ± 0.01 | 0.02 ± 0.01 | 0.13 ± 0.01 | 0.07 ± 0.03 | 0.02 ± 0.02 | 0.03 ± 0.02 | 0.13 ± 0.06 | 0.04 ± 0.01 | 0.03 ± 0.00 | 0.04 ± 0.01 | 0.03 ± 0.00 | 0.07 ± 0.02 | 0.04 ± 0.00 | 0.06 ± 0.01 |
81 | 18.47 | 1923 | Glucose, (5TMS) | 0.03 ± 0.04 | 0.01 ± 0.00 | 0.01 ± 0.00 | 0.02 ± 0.00 | 0.01 ± 0.00 | 0.01 ± 0.01 | 0.01 ± 0.00 | 0.03 ± 0.02 | 0.02 ± 0.01 | 0.01 ± 0.00 | 0.03 ± 0.02 | 0.02 ± 0.00 | 0.03 ± 0.01 | 0.02 ± 0.01 | 0.02 ± 0.00 |
82 | 19.04 | 1976.2 | d-Allofuranose, (5TMS) | 0.02 ± 0.01 | 0.01 ± 0.00 | 0.02 ± 0.01 | 0.03 ± 0.01 | 0.05 ± 0.04 | 0.02 ± 0.02 | 0.05 ± 0.03 | 0.02 ± 0.00 | 0.03 ± 0.00 | 0.01 ± 0.00 | 0.10 ± 0.07 | 0.66 ± 0.24 | 1.84 ± 0.59 | 0.86 ± 0.72 | 1.07 ± 0.28 |
83 | 19.25 | 1996.7 | d-Glucose, (5TMS) | 0.03 ± 0.01 | 0.02 ± 0.01 | 0.03 ± 0.01 | 0.19 ± 0.02 | 0.09 ± 0.04 | 0.03 ± 0.02 | 0.04 ± 0.02 | 0.15 ± 0.07 | 0.05 ± 0.02 | 0.03 ± 0.00 | 0.05 ± 0.02 | 0.05 ± 0.00 | 0.09 ± 0.04 | 0.06 ± 0.00 | 0.09 ± 0.01 |
84 | 19.36 | 2006.6 | Galactofuranose, (5TMS) | 0.01 ± 0.00 | 0.00 ± 0.00 | 0.00 ± 0.00 | 0.01 ± 0.00 | 0.01 ± 0.00 | 0.01 ± 0.01 | 0.00 ± 0.00 | 0.01 ± 0.00 | 0.01 ± 0.00 | 0.01 ± 0.00 | 0.02 ± 0.01 | 0.01 ± 0.00 | 0.01 ± 0.00 | 0.01 ± 0.01 | 0.01 ± 0.01 |
85 | 24.80 | 2624.2 | Sucrose isomer | 0.01 ± 0.00 | 0.00 ± 0.00 | 0.00 ± 0.00 | 0.09 ± 0.03 | 0.14 ± 0.10 | 0.09 ± 0.14 | 0.01 ± 0.00 | 0.05 ± 0.06 | 0.05 ± 0.00 | 0.01 ± 0.01 | 0.10 ± 0.05 | 0.15 ± 0.09 | 0.03 ± 0.02 | 0.17 ± 0.09 | 0.13 ± 0.03 |
86 | 25.15 | 2670.9 | Trehalose, (8TMS) | 0.00 ± 0.00 | 0.00 ± 0.00 | 0.00 ± 0.00 | 0.02 ± 0.01 | 0.03 ± 0.02 | 0.01 ± 0.01 | 0.01 ± 0.00 | 0.01 ± 0.01 | 0.02 ± 0.01 | 0.01 ± 0.00 | 0.02 ± 0.01 | 0.04 ± 0.02 | 0.01 ± 0.01 | 0.05 ± 0.02 | 0.04 ± 0.01 |
87 | 25.26 | 2684.7 | Sucrose, (8TMS) | 0.47 ± 0.25 | 0.04 ± 0.02 | 0.16 ± 0.10 | 16.29 ± 4.27 | 17.58 ± 10.68 | 4.61 ± 6.73 | 0.57 ± 0.76 | 1.85 ± 2.30 | 3.80 ± 1.26 | 1.11 ± 0.30 | 13.25 ± 5.85 | 19.08 ± 9.22 | 4.64 ± 2.79 | 18.85 ± 6.27 | 14.70 ± 1.78 |
88 | 25.42 | 2685.4 | d-Trehalose, (8TMS) | 0.07 ± 0.04 | 0.03 ± 0.00 | 0.03 ± 0.00 | 1.36 ± 0.82 | 0.69 ± 0.17 | 0.31 ± 0.47 | 0.04 ± 0.01 | 0.04 ± 0.01 | 0.05 ± 0.01 | 0.04 ± 0.01 | 0.06 ± 0.01 | 0.07 ± 0.02 | 0.06 ± 0.02 | 0.09 ± 0.03 | 0.08 ± 0.01 |
89 | 25.85 | 2759.5 | d-Glucopyranose, 4[TMS)-beta-d-galactopyranosyl (4TMS) | 0.01 ± 0.00 | 0.00 ± 0.00 | 0.01 ± 0.00 | 0.02 ± 0.00 | 0.05 ± 0.02 | 0.01 ± 0.02 | 0.01 ± 0.01 | 0.03 ± 0.01 | 0.02 ± 0.01 | 0.02 ± 0.00 | 0.01 ± 0.00 | 0.02 ± 0.01 | 0.01 ± 0.00 | 0.05 ± 0.07 | 0.01 ± 0.00 |
90 | 26.23 | 2804.8 | β-Gentiobiose, (8TMS) | 0.05 ± 0.05 | 0.01 ± 0.00 | 0.32 ± 0.34 | 3.82 ± 1.65 | 6.34 ± 5.63 | 1.47 ± 2.13 | 0.35 ± 0.23 | 0.39 ± 0.54 | 0.57 ± 0.15 | 0.94 ± 0.20 | 0.55 ± 0.23 | 0.33 ± 0.22 | 0.02 ± 0.01 | 0.40 ± 0.11 | 0.31 ± 0.03 |
91 | 31.60 | Unknown disaccharide | 0.45 ± 0.40 | 0.01 ± 0.00 | 0.66 ± 0.81 | 4.54 ± 2.80 | 2.54 ± 1.09 | 3.12 ± 4.01 | 0.71 ± 1.07 | 0.31 ± 0.30 | 2.15 ± 0.08 | 1.86 ± 0.27 | 2.66 ± 0.70 | 4.92 ± 0.66 | 1.68 ± 0.51 | 10.02 ± 2.73 | 8.28 ± 1.36 | |
Total sugars | 1.17 | 0.15 | 1.27 | 26.55 | 27.62 | 9.71 | 1.84 | 3.02 | 6.82 | 4.07 | 16.90 | 25.38 | 8.49 | 30.63 | 24.80 | |||
Terpenes/steroids | ||||||||||||||||||
92 | 6.08 | 1032 | Limonene | 0.19 ± 0.14 | 0.16 ± 0.11 | 0.04 ± 0.00 | 0.12 ± 0.13 | 0.23 ± 0.16 | 0.20 ± 0.02 | 0.11 ± 0.10 | 0.27 ± 0.02 | 0.15 ± 0.12 | 0.06 ± 0.02 | 0.24 ± 0.18 | 0.14 ± 0.17 | 0.12 ± 0.11 | 0.18 ± 0.11 | 0.32 ± 0.06 |
93 | 6.14 | 1035.6 | Cineole (Eucalyptol) | 0.07 ± 0.06 | 0.07 ± 0.05 | 0.01 ± 0.00 | 0.05 ± 0.06 | 0.09 ± 0.07 | 0.07 ± 0.01 | 0.04 ± 0.05 | 0.10 ± 0.01 | 0.06 ± 0.05 | 0.01 ± 0.01 | 0.08 ± 0.06 | 0.04 ± 0.05 | 0.04 ± 0.05 | 0.07 ± 0.05 | 0.13 ± 0.03 |
94 | 26.34 | 2815.9 | Squalene | 0.14 ± 0.04 | 0.08 ± 0.03 | 0.09 ± 0.03 | 0.26 ± 0.04 | 0.16 ± 0.03 | 0.41 ± 0.35 | 0.30 ± 0.23 | 0.82 ± 0.98 | 1.63 ± 1.20 | 0.55 ± 0.19 | 1.17 ± 0.45 | 0.31 ± 0.21 | 0.25 ± 0.05 | 0.51 ± 0.31 | 0.27 ± 0.23 |
95 | 27.63 | 2935.7 | Tocopherol-γ-Tms-derivative | 0.01 ± 0.00 | 0.01 ± 0.00 | 0.01 ± 0.00 | 0.01 ± 0.00 | 0.01 ± 0.00 | 0.02 ± 0.00 | 0.02 ± 0.00 | 0.01 ± 0.00 | 0.01 ± 0.01 | 0.02 ± 0.00 | 0.03 ± 0.00 | 0.03 ± 0.00 | 0.01 ± 0.00 | 0.12 ± 0.16 | 0.01 ± 0.00 |
96 | 28.64 | 3034.3 | Stigmastan-3,5-diene | 0.03 ± 0.00 | 0.02 ± 0.00 | 0.02 ± 0.00 | 0.03 ± 0.00 | 0.03 ± 0.00 | 0.06 ± 0.01 | 0.07 ± 0.01 | 0.04 ± 0.00 | 0.04 ± 0.00 | 0.06 ± 0.00 | 0.03 ± 0.03 | 0.03 ± 0.00 | 0.02 ± 0.01 | 0.53 ± 0.85 | 0.04 ± 0.00 |
97 | 30.81 | 3263.1 | β-Sitosterol TMS | 0.12 ± 0.01 | 0.06 ± 0.00 | 0.08 ± 0.01 | 0.17 ± 0.05 | 0.30 ± 0.10 | 0.14 ± 0.05 | 0.15 ± 0.01 | 0.09 ± 0.00 | 0.07 ± 0.04 | 0.11 ± 0.01 | 0.09 ± 0.06 | 0.19 ± 0.04 | 0.22 ± 0.07 | 0.69 ± 0.61 | 0.38 ± 0.03 |
98 | 31.12 | 3297.4 | β-Amyrin TMS | 0.01 ± 0.00 | 0.01 ± 0.01 | 0.01 ± 0.01 | 0.06 ± 0.03 | 0.02 ± 0.01 | 0.05 ± 0.03 | 0.02 ± 0.00 | 0.06 ± 0.01 | 0.61 ± 0.38 | 0.17 ± 0.01 | 0.15 ± 0.06 | 0.01 ± 0.01 | 0.01 ± 0.00 | 0.02 ± 0.01 | 0.04 ± 0.01 |
Total terpenes/steroids | 0.57 | 0.40 | 0.26 | 0.68 | 0.84 | 0.95 | 0.70 | 1.39 | 2.57 | 0.97 | 1.78 | 0.76 | 0.67 | 2.12 | 1.18 | |||
