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Table 3 LC–MS measurement parameters of differentially expressed serum components in TBHLD

From: Tongbi Huoluo Decoction alleviates cartilage degeneration in knee osteoarthritis by inhibiting degradation of extracellular matrix

No

Name

mz

rt/s

ppm

log2FC

p.value

VIP

Type

1

5-Hydroxypentanoic acid

119.073

201.6

22.87672

− 0.45

0.008342

1.683273

pos

2

L-Leucine

132.1019

80.8

0.181678

0.31

0.012864

1.66091

pos

3

5,6-Dihydro-5-fluorouracil

133.0318

72.2

0.006806

− 0.33

0.015022

1.624164

pos

4

Acetylphosphate

139.982

31.9

0.435395

− 0.23

0.03028

1.552004

pos

5

3,4-Dihydroxyphenylglycol

169.9773

92.7

0.452329

− 1.73

0.003585

1.728516

pos

6

3,4-Dihydroxymandelic acid

184.1695

126.5

1.390554

0.72

0.028783

1.555177

pos

7

N6-Acetyl-L-lysine

189.1234

45.6

0.000388

0.54

0.011194

1.671375

pos

8

Thiabendazole

202.044

201.4

1.113206

− 0.4

0.009698

1.678637

pos

9

Deoxyuridine

228.1958

641.8

0.06115

− 1.35

0.00684

1.698428

pos

10

Myristic acid

229.1797

412.6

1.785623

− 0.51

0.00848

1.693119

pos

11

Oleic acid

282.2787

521

0.632864

− 0.74

0.035148

1.541356

pos

12

9-cis-Retinal

285.2195

529.9

6.226783

1.01

0.044273

1.498674

pos

13

Sphinganine

302.3042

491.1

0.969481

− 0.66

0.008316

1.789165

pos

14

1-Arachidonoylglycerol

361.2723

462.4

1.648725

0.71

0.024507

1.602941

pos

15

Glycyrrhetinate

453.3405

555.5

18.38353

8.72

2.12E-05

1.818695

pos

16

Avermectin A2a aglycone

616.3658

432.8

7.6254

0.78

0.026296

1.576102

pos

17

L-Aspartate-semialdehyde

116.0352

48

1.06864

0.67

0.012096

1.65956

neg

18

4-Coumaryl alcohol

131.0501

192.5

2.975961

2.65

0.046341

1.527998

neg

19

D-Xylose

149.0093

544.6

7.012952

0.41

0.04028

1.476882

neg

20

D-Ribose

149.9939

550.4

5.387926

− 1.55

0.00701

1.664844

neg

21

Nicotine

160.9331

689.6

8.20923

2.28

1.15E-05

1.810164

neg

22

Quinate

173.0447

136.4

1.791445

0.41

0.04958

1.503161

neg

23

L-Arginine

173.1042

59.8

1.294018

0.36

0.016083

1.593975

neg

24

Guanidinosuccinic acid

174.9571

118.8

12.42855

3.73

0.036359

1.51136

neg

25

N-Acetylserotonin

199.1702

518.6

5.170116

0.22

0.048617

1.507976

neg

26

Deoxycytidine

226.0828

72.8

2.211579

0.52

0.036608

1.477014

neg

27

9(S)-HPODE

293.2118

462.9

0.306945

0.95

0.010478

1.669072

neg

28

5′-Methylthioadenosine

297.2452

554.8

6.130677

1.58

0.016614

1.653746

neg

29

5-KETE

317.2107

465.3

4.728718

1.35

0.020487

1.589074

neg

30

16(R)-HETE

319.2256

497.6

6.96686

1.39

0.023236

1.553453

neg

31

Prostaglandin F2a

335.2198

418

7.189313

1.18

0.043442

1.477773

neg

32

Hepoxilin B3

335.2206

450.3

6.562842

1

0.005992

1.673223

neg

  1. mz: mass-to-charge ratio; rt: retention time; type: ionization mode, pos for positive ion mode, neg for negative ion mode; ppm: parts per million; VIP: variable importance in projection value of OPLS-DA first principal component