Table 1 Statistics of differential metabolites recovered by HRW

1

Bisdiphosphoinositol tetrakisphosphate

704.8074441

0.74

Neg

C₆H₂₀O₂₄P₈

↓

↑

2

PC(20:1(11Z)/24:0)

880.7169796

0.74

Neg

C₅₂H₁₀₂NO₈P

↓

↑

3

Choline

104.1073217

0.78

Pos

C₅H₁₃NO

↓

↑

4

alpha-methyl butyric Acid

120.1020555

0.78

Pos

C₅H₁₀O₂

↓

↑

5

Ribothymidine

276.1187823

0.8

Pos

C₁₀H₁₄N₂O₆

↑

↓

6

2-N,6-N-Bis(2,3-dihydroxybenzoyl)-L-lysine

399.1192105

0.81

Neg

C₂₀H₂₂N₂O₈

↑

↓

7

Ribose 1-phosphate

229.0114577

0.82

Neg

C₅H₁₁O₈P

↑

↓

8

Norophthalmic acid

274.1046339

0.82

Neg

C₁₀H₁₇N₃O₆

↑

↓

9

Caproic acid

134.1174357

0.84

Pos

C₆H₁₂O₂

↓

↑

10

Drazoxolon

238.0377343

0.86

Pos

C₁₀H₈C_lN₃O₂

↑

↓

11

 S-Cysteinosuccinic acid

236.0230962

0.87

Neg

C₇H₁₁NO₆S

↑

↓

12

Succinylproline

233.1129797

0.88

Pos

C₉H₁₃NO₅

↓

↑

13

Glutathionate(1-)

308.090742

0.88

Pos

C₁₀H₁₇N₃O₆S

↑

↓

14

gamma-Glutamylglutamic acid

275.0886761

0.89

Neg

C₁₀H₁₆N₂O₇

↑

↓

15

Maleic hydrazide

113.0348169

0.89

Pos

C₄H₄N₂O₂

↓

↑

16

(4 S,5 S)-4,5-dihydroxy-2,6-dioxohexanoic acid

351.0571659

0.89

Neg

C₆H₈O₆

↑

↓

17

Itaconic acid

175.0237955

0.89

Neg

C₅H₆O₄

↑

↓

18

Aristolodione

306.0765161

0.89

Neg

C₁₈H₁₃NO₄

↑

↓

19

Isobutyric acid

175.098179

0.91

Neg

C₄H₈O₂

↑

↓

20

D-Lysine

191.1036811

0.94

Neg

C₆H₁₄N₂O₂

↓

↑

21

Propaphos

343.0535487

0.95

Pos

C₁₃H₂₁O₄PS

↓

↑

22

ADP-ribose

604.0705895

1.05

Neg

C₁₅H₂₃N₅O₁₄P₂

↑

↓

23

a-L-threo-4-Hex-4-enopyranuronosyl-D-galacturonic acid

351.0571152

1.17

Neg

C₁₂H₁₆O₁₂

↑

↓

24

D-Glucuronic acid

175.0238612

1.17

Neg

C₆H₁₀O₇

↑

↓

25

Glutathione

306.0763654

1.23

Neg

C₁₀H₁₇N₃O₆S

↑

↓

26

Letrozole

308.0905898

1.24

Pos

C₁₇H₁₁N₅

↑

↓

27

3,4,5-trihydroxy-6-(2-oxo-1,3-diphenylpropoxy)oxane-2-carboxylic acid

385.1282845

1.24

Pos

C₂₁H₂₂O₈

↑

↓

28

Pseudouridine

245.0766217

1.27

Pos

C₉H₁₂N₂O₆

↑

↓

29

(R)-3-hydroxybutyrylcarnitine

248.1490203

1.28

Pos

C₁₁H₂₁NO₅

↓

↑

30

[2-hydroxy-5-(2-hydroxy-3-methoxy-3-oxopropyl)phenyl]oxidanesulfonic acid

310.0586886

1.38

Pos

C₁₀H₁₂O₈S

↑

↓

31

2-(alpha-D-Galactosyl)-sn-glycerol 3-phosphate

143.0702116

1.39

Pos

C₇H₁₂O₄

↓

↑

32

Cysteine-Homocysteine disulfide

299.037998

1.39

Neg

C₇H₁₄N₂O₄S₂

↑

↓

33

Isoguanosine

284.0986875

1.42

Pos

C₁₀H₁₃N₅O₅

↓

34

Guanosine

282.0844741

1.44

Neg

C₁₀H₁₃N₅O₅

↓

↑

35

 L-Ascorbic acid-2-glucoside

383.0846362

1.44

Neg

C₁₂H₁₈O₁₁

↑

↓

36

1,4-beta-D-Glucan

537.1685822

1.45

Pos

C₁₈H₃₂O₁₈

↑

↓

37

Allopurinol-1-ribonucleoside

269.0878499

1.45

Pos

C₁₀H₁₂N₄O₅

↑

↓

38

Arabinosylhypoxanthine

267.0736398

1.45

Neg

C₁₀H₁₂N₄O₅

↑

↓

39

Allopurinol

137.0457685

1.45

Pos

C₅H₄N₄O

↑

↓

40

5-fluoroindole-2-carboxylic Acid

357.0689298

1.45

Neg

C₉H₆FNO₂

↑

↓

41

Elephantorrhizol

303.0502085

1.45

Neg

C₁₅H₁₄O₈

↓

42

Saphenamycin

803.2361443

1.45

Neg

C₂₃H₁₈N₂O₅

↑

↓

43

Pyrocatechol glucuronide

571.1311958

1.46

Neg

C₁₂H₁₄O₈

↑

↓

44

Isosorbide Dinitrate

281.0272222

1.49

Neg

C₆H₈N₂O₈

↑

↓

45

Carotamine

310.0588562

1.8

Pos

C₁₄H₁₃N₃O₃

↑

↓

46

Glutamyltyrosine

311.1235281

2.82

Pos

C₁₄H₁₈N₂O₆

↓

↑

47

Pantothenic Acid

220.1178617

3.09

Pos

C₉H₁₇NO₅

↓

↑

48

 S-(4,5-Dihydro-2-methyl-3-furanyl) ethanethioate

176.0739269

4.07

Pos

C₇H₁₀O₂S

↑

↓

49

5β-cholanic Acid-3α, 12α-diol N-(2-sulphoethyl)-amide

538.2619276

4.20

Pos

C₂₆H₄₅NO₆S

↑

↓

50

gamma-Glutamylleucine

261.1444168

4.55

Pos

C₁₁H₂₀N₂O₅

↓

↑

51

LysoPE(0:0/18:1(11Z))

480.3084895

11.46

Pos

C₂₃H₄₆NO₇P

↓

↑

52

LysoPE(18:1(11Z)/0:0)

480.3083533

11.61

Pos

C₂₃H₄₆NO₇P

↓

↑

53

Stearoylethanolamide

328.3207028

14.15

Pos

C₂₀H₄₁NO₂

↓

↑

54

4-(beta-Acetylaminoethyl)imidazole

154.0973617

15.53

Pos

C₇H₁₁N₃O

↑

↓