Location:
Metabolite
> Tentative peak list
| ID |
R.T. |
m/z |
Peak Area |
Compound Acc. |
Molecular Weight |
PubChem ID |
KEGG Compound Acc. |
Involved Unigenes |
Involved Probesets |
| 1 |
1.4685 |
285.06 |
5.00 |
Gentisic acid-pentose |
|
|
|
|
|
| 2 |
1.6711 |
179.03 |
25.00 |
Caffeic acid-hexose |
|
|
|
|
|
| 3 |
1.8051 |
651.19 |
48.00 |
p-Coumaric aicd-hexose |
|
|
|
|
|
| 4 |
2.201 |
137.02 |
3.40 |
Hydorxybenzoic acid-hexose |
|
|
|
|
|
| 5 |
2.2529 |
193.05 |
10.70 |
Ferulic acid-hexose |
|
|
|
|
|
| 6 |
2.6581 |
673.17 |
6.50 |
m-Coumaric acid-hexose |
|
|
|
|
|
| 7 |
2.7557 |
223.06 |
7.30 |
Sinapinic acid-hexose |
|
|
|
|
|
| 8 |
3.1286 |
451.12 |
10.70 |
Epicatechine-hexose |
|
|
|
|
|
| 9 |
3.3921 |
449.11 |
9.20 |
(+) -Dihydrokaempferol-hexose |
|
|
|
|
|
| 10 |
5.1128 |
609.15 |
73.40 |
Luteolin-3,7-O-glucose |
|
|
|
|
|
| 11 |
5.3355 |
607.13 |
18.40 |
Pseudopurpurin-hexose-deoxyhexose |
|
|
|
|
|
| 12 |
5.8216 |
447.09 |
0.00 |
Luteolin5'-7-O-glucoside |
|
|
|
|
|
| 13 |
5.9565 |
431.06 |
40.50 |
Genistin |
432.38 |
5281377 |
C09126 |
|
|
| 14 |
6.0494 |
447.09 |
96.00 |
Luteolin5'-7-O-glucoside |
|
|
|
|
|
| 15 |
6.1348 |
477.10 |
11.10 |
6-Methoxyluteolin-hexose |
|
|
|
|
|
| 16 |
6.2836 |
593.15 |
158.80 |
Kaempferol-3-O-rutinoside |
594.52 |
20055286 |
|
|
|
| 17 |
6.4373 |
447.09 |
171.80 |
Luteolin-4-O-glucose |
|
|
|
|
|
| 18 |
6.735 |
285.04 |
59.40 |
Kaempferol-7-O-glucoside |
447.37 |
25246267 |
|
|
|
| 19 |
6.899 |
431.10 |
95.90 |
Apigenin-7-o-glucoside |
432.38 |
5280704 |
C04608 |
|
|
| 20 |
6.9723 |
489.10 |
115.30 |
Kaempferol 3-(6''-acetylglucoside) |
|
|
|
|
|
| 21 |
7.2805 |
591.13 |
2.80 |
Luteolin-rutinose |
|
|
|
|
|
| 22 |
7.4797 |
461.11 |
17.10 |
Azaleatin-deoxyhexose |
|
|
|
|
|
| 23 |
7.5694 |
503.25 |
3.90 |
|
|
|
|
|
|
| 24 |
7.6569 |
491.12 |
5.50 |
Quercetin-5,3'-dimethyl ether-3-glucoside |
|
|
|
|
|
| 25 |
7.7569 |
477.10 |
4.10 |
Azaleatin-hexose |
|
|
|
|
|
| 26 |
7.9933 |
259.19 |
18.20 |
|
|
|
|
|
|
| 27 |
8.0007 |
491.12 |
4.70 |
|
|
|
|
|
|
| 28 |
8.2261 |
259.19 |
26.80 |
|
|
|
|
|
|
| 29 |
8.5669 |
607.11 |
23.50 |
Biochanin A b-D-diglucoside |
|
|
|
|
|
| 30 |
8.7505 |
255.03 |
24.20 |
Luteolin |
286.24 |
5280445 |
C01514 |
|
33 probesets |
| 31 |
9.0823 |
421.21 |
21.50 |
|
|
|
|
|
|
| 32 |
9.3254 |
567.27 |
4.00 |
|
|
|
|
|
|
| 33 |
9.6023 |
593.13 |
85.30 |
Luteolin-coumaroylhexose |
|
|
|
|
|
| 34 |
9.6955 |
1,105.55 |
0.50 |
|
|
|
|
|
|
| 35 |
9.7561 |
1,119.56 |
0.70 |
|
|
|
|
|
|
| 36 |
9.9063 |
551.26 |
8.00 |
|
|
|
|
|
|
| 37 |
10.0371 |
593.13 |
16.00 |
|
|
|
|
|
|
| 38 |
10.2812 |
269.04 |
25.50 |
Genistein |
270.24 |
5280961 |
C06563 |
|
|
| 39 |
10.3023 |
1,089.55 |
1.80 |
|
|
|
|
|
|
| 40 |
10.4282 |
285.04 |
1.90 |
Kaempferol |
286.24 |
5280863 |
C05903 |
|
140 probesets |
| 41 |
10.5625 |
447.22 |
12.00 |
|
|
|
|
|
|
| 42 |
10.6104 |
558.26 |
2.70 |
|
|
|
|
|
|
| 43 |
10.6935 |
461.11 |
9.00 |
Isokaempferide-hexose |
|
|
|
|
|
| 44 |
10.8316 |
309.10 |
4.10 |
|
|
|
|
|
|
| 45 |
10.8965 |
661.36 |
1.90 |
|
|
|
|
|
|
| 46 |
10.9748 |
283.06 |
2.60 |
Isokaempferide |
|
|
|
|
|
| 47 |
11.1336 |
1,103.56 |
15.50 |
|
|
|
|
|
|
| 48 |
11.2035 |
1,235.54 |
11.60 |
|
|
|
|
|
|
| 49 |
11.3078 |
1,515.66 |
2.00 |
Saponin(Cyclamin) |
1223.35 |
198016 |
C08938 |
|
|
| 50 |
11.3977 |
1,677.71 |
19.20 |
|
|
|
|
|
|
| 51 |
11.4073 |
1,545.66 |
82.70 |
|
|
|
|
|
|
| 52 |
11.4781 |
405.25 |
21.50 |
|
|
|
|
|
|
| 53 |
11.6011 |
841.42 |
2.20 |
|
|
|
|
|
|
| 54 |
11.6123 |
1,413.62 |
15.60 |
|
|
|
|
|
|
| 55 |
11.8096 |
1,249.55 |
2.80 |
|
|
|
|
|
|
| 56 |
11.8231 |
1,383.61 |
11.30 |
|
|
|
|
|
|
| 57 |
11.8583 |
343.08 |
3.40 |
|
|
|
|
|
|
| 58 |
12.0037 |
1,221.56 |
51.60 |
|
|
|
|
|
|
| 59 |
12.1115 |
486.24 |
5.30 |
|
|
|
|
|
|
| 60 |
12.1526 |
1,397.62 |
0.10 |
3-Glc-Glc-Glc-28-Ara-Rha-Xyl-medicagenic Acid |
|
|
|
|
|
| 61 |
12.1709 |
281.14 |
36.30 |
|
|
|
|
|
|
| 62 |
12.5494 |
327.22 |
1.90 |
|
|
|
|
|
|
| 63 |
12.6024 |
395.14 |
27.60 |
|
|
|
|
|
|
| 64 |
12.8218 |
696.28 |
10.50 |
|
|
|
|
|
|
| 65 |
12.963 |
1,305.55 |
84.50 |
Saponin(Cyclamin) |
1223.35 |
198016 |
C08938 |
|
|
| 66 |
13.0381 |
1,529.67 |
26.50 |
3-Glc-Glc-Glc-28-Ara-Rha-(Api) -Xyl-medicagenic Acid |
|
|
|
|
|
| 67 |
13.0392 |
1,661.71 |
1.30 |
3-Glc-Glc-Glc-28-Ara-Rha-(Api) -Xyl-medicagenic Acid + pen |
|
|
|
|
|
| 68 |
13.1966 |
1,397.63 |
4.80 |
3-Glc-Glc-Glc-28-Ara-Rha-Xyl-medicagenic Acid |
|
|
|
|
|
| 69 |
13.2642 |
1,219.55 |
15.50 |
|
|
|
|
|
|
| 70 |
13.4181 |
1,087.50 |
152.60 |
3-GlcA,28-Ara-Rha-Xyl-medicagenic acid |
1074.21 |
6711869 |
|
|
|
| 71 |
13.5371 |
809.40 |
8.80 |
|
|
|
|
|
|
| 72 |
13.59 |
481.14 |
20.20 |
|
|
|
|
|
|
| 73 |
13.6 |
1,367.62 |
6.00 |
|
|
|
|
|
|
| 74 |
13.8037 |
1,235.58 |
20.10 |
3-Glc-Glc,28-Ara-Rha-Xyl-medicagenic Acid |
1237.33 |
6711870 |
|
|
|
| 75 |
13.9171 |
1,173.50 |
63.40 |
|
|
|
|
|
|
| 76 |
14.0467 |
1,073.52 |
16.80 |
3-Glc-28-Ara-Rha-Xyl-medicagenic Acid |
|
|
|
|
|
| 77 |
14.1977 |
243.20 |
23.70 |
10,16-Dihydroxy-hexadecanoate |
|
|
|
|
|
| 78 |
14.3504 |
939.46 |
8.00 |
|
|
|
|
|
|
| 79 |
14.5824 |
969.47 |
12.30 |
|
|
|
|
|
|
| 80 |
14.5898 |
241.18 |
4.00 |
Hexadecane-1,16-dioate |
|
|
|
|
|
| 81 |
14.7004 |
823.41 |
7.20 |
|
|
|
|
|
|
| 82 |
14.8283 |
283.06 |
0.60 |
Biochanin A |
284.26 |
5280373 |
C00814 |
|
|
| 83 |
15.3281 |
1,229.60 |
2.60 |
|
|
|
|
|
|
| 84 |
15.6029 |
1,043.51 |
12.70 |
|
|
|
|
|
|
| 85 |
15.7935 |
1,085.55 |
5.50 |
|
|
|
|
|
|
| 86 |
15.9054 |
911.47 |
50.20 |
|
|
|
|
|
|
| 87 |
15.9231 |
343.08 |
0.10 |
|
|
|
|
|
|
| 88 |
16.2123 |
309.17 |
7.20 |
|
|
|
|
|
|
| 89 |
16.337 |
653.43 |
8.30 |
|
|
|
|
|
|
| 90 |
16.4061 |
221.15 |
9.20 |
|
|
|
|
|
|
| 91 |
16.8687 |
1,043.55 |
18.80 |
|
|
|
|
|
|
| 92 |
17.3856 |
941.51 |
85.00 |
Rha-Hex-Hex-hederagenin |
|
|
|
|
|
| 93 |
17.7319 |
271.23 |
6.70 |
16-Hydroxyhexadecanoic acid |
|
|
|
|
|
| 94 |
17.9271 |
271.23 |
7.50 |
16-Hydroxyhexadecanoic acid |
|
|
|
|
|
| 95 |
18.1658 |
269.21 |
3.80 |
|
|
|
|
|
|
| 96 |
18.2043 |
1,027.52 |
3.00 |
|
|
|
|
|
|
| 97 |
18.2151 |
1,043.55 |
2.30 |
|
|
|
|
|
|
| 98 |
18.8569 |
939.50 |
8.00 |
|
|
|
|
|
|
| 99 |
19.2786 |
1,067.55 |
30.70 |
|
|
|
|
|
|
| 100 |
19.397 |
241.18 |
37.60 |
|
|
|
|
|
|
| 101 |
19.9161 |
241.18 |
39.90 |
|
|
|
|
|
|
| 102 |
21.8073 |
265.15 |
47.50 |
|
|
|
|
|
|
| 103 |
23.7779 |
476.28 |
20.70 |
|
|
|
|
|
|
| 104 |
23.8952 |
504.31 |
8.50 |
|
|
|
|
|
|
| 105 |
24.0066 |
297.24 |
17.00 |
18-Hydroxy-9-octadecenoic acid |
|
|
|
|
|
| 106 |
24.148 |
227.20 |
142.40 |
Myristic acid |
228.37 |
11005 |
C06424 |
|
5 probesets |
| 107 |
24.6478 |
199.17 |
47.30 |
Lauric acid |
200.32 |
3893 |
C02679 |
|
5 probesets |
| 108 |
24.9545 |
452.28 |
7.10 |
|
|
|
|
|
|
| 109 |
25.093 |
480.31 |
6.60 |
|
|
|
|
|
|
| 110 |
25.5925 |
476.28 |
0.40 |
|
|
|
|
|
|
| 111 |
25.5964 |
257.17 |
6.20 |
|
|
|
|
|
|
| 112 |
26.1598 |
341.27 |
100.00 |
|
|
|
|
|
|
| 113 |
26.3 |
293.18 |
0.00 |
|
|
|
|
|
|
| 114 |
26.3023 |
421.22 |
844.90 |
|
|
|
|
|
|
| 115 |
30.5922 |
279.23 |
164.60 |
Linoleic Acid |
280.45 |
5280450 |
C01595 |
CO512144 CO516553
AF195800 AF195801
AF195802 AJ249245
AJ249246 AJ249247
ALFEICA4HA CO512107
CO514181 CO515318
CO515393 CO516404
CO517115 DQ222911
DQ222912 EX521724
EX522214 TCMS40296
TCMS40772 TCMS40812
TCMS40889 |
138 probesets |
| 116 |
30.958 |
299.26 |
68.00 |
18-Hydroxyoctadecanoic acid |
|
|
|
|
|
| 117 |
31.2581 |
402.30 |
8.50 |
|
|
|
|
|
|
| 118 |
31.6017 |
395.32 |
231.10 |
|
|
|
|
|
|
| 119 |
31.8493 |
255.23 |
115.00 |
Palmitic acid |
256.42 |
985 |
C00249 |
CO512624 CO511788
CO512671 CO517215
EX522106 EX523436
EX524321 EX525256
EX525386 EX525457
|
57 probesets |
| 120 |
32.0873 |
402.30 |
120.50 |
|
|
|
|
|
|
| 121 |
32.2382 |
395.32 |
0.00 |
|
|
|
|
|
|
| 122 |
32.3945 |
469.33 |
22.70 |
Gypsogenin |
470.68 |
92825 |
C08950 |
|
|
| 123 |
32.6116 |
307.30 |
155.20 |
|
|
|
|
|
|
| 124 |
32.8091 |
327.29 |
19.10 |
20-Hydroxyeicosanoic acid |
|
|
|
|
|
| 125 |
33.091 |
397.33 |
339.50 |
1,24-Tetracosane dioic acid |
|
|
|
|
|
| 126 |
33.651 |
321.21 |
1,489.60 |
|
|
|
|
|
|
|