Table 2 Components in DTT for further analysis after AD ME screening

Fuling

MOL000273

(2R)-2-[(3S,5R,10S,13R,14R,16R,17R)-3,16-dihydroxy-4,4,10,13,14-pentamethyl-2,3,5,6,12,15,16,17-octahydro-1H-cyclopenta[a]phenanthren-17-yl]-6-methylhept-5-enoic acid

30.93

0.01

0.81

Fuling

MOL000275

trametenolic acid

38.71

0.52

0.80

Fuling

MOL000276

7,9(11)-dehydropachymic acid

35.11

0.03

0.81

Fuling

MOL000279

Cerevisterol

37.96

0.28

0.77

Fuling

MOL000280

(2R)-2-[(3S,5R,10S,13R,14R,16R,17R)-3,16-dihydroxy-4,4,10,13,14-pentamethyl-2,3,5,6,12,15,16,17-octahydro-1H-cyclopenta[a]phenanthren-17-yl]-5-isopropyl-hex-5-enoic acid

31.07

0.05

0.82

Fuling

MOL000282

ergosta-7,22E-dien-3beta-ol

43.51

1.32

0.72

Fuling

MOL000283

Ergosterol peroxide

40.36

0.84

0.81

Fuling

MOL000285

(2R)-2-[(5R,10S,13R,14R,16R,17R)-16-hydroxy-3-keto-4,4,10,13,14-pentamethyl-1,2,5,6,12,15,16,17-octahydrocyclopenta[a]phenanthren-17-yl]-5-isopropyl-hex-5-enoic acid

38.26

0.12

0.82

Fuling

MOL000287

3beta-Hydroxy-24-methylene-8-lanostene-21-oic acid

38.70

0.61

0.81

Fuling

MOL000289

pachymic acid

33.63

0.10

0.81

Fuling

MOL000290

Poricoic acid A

30.61

-0.14

0.76

Fuling

MOL000291

Poricoic acid B

30.52

-0.08

0.75

Fuling

MOL000292

poricoic acid C

38.15

0.32

0.75

Fuling

MOL000296

hederagenin

36.91

1.32

0.75

Fuling

MOL000300

dehydroeburicoic acid

44.17

0.38

0.83

Renshen

MOL000358

beta-sitosterol

36.91

1.32

0.75

Renshen

MOL000422

kaempferol

41.88

0.26

0.24

Renshen

MOL000449

Stigmasterol

43.83

1.44

0.76

Renshen

MOL000749

Linoleic

41.90

1.23

0.14

Renshen

MOL000787

Fumarine

59.26

0.56

0.83

Renshen

MOL001641

METHYL LINOLEATE

41.93

1.44

0.17

Renshen

MOL002879

Diop

43.59

0.79

0.39

Renshen

MOL003648

Inermin

65.83

0.91

0.54

Renshen

MOL004492

Chrysanthemaxanthin

38.72

0.51

0.58

Renshen

MOL005308

Aposiopolamine

66.65

0.66

0.22

Renshen

MOL005314

Celabenzine

101.88

0.77

0.49

Renshen

MOL005317

Deoxyharringtonine

39.27

0.19

0.81

Renshen

MOL005320

arachidonate

45.57

1.27

0.20

Renshen

MOL005321

Frutinone A

65.90

0.89

0.34

Renshen

MOL005348

Ginsenoside-Rh4_qt

31.11

0.50

0.78

Renshen

MOL005356

Girinimbin

61.22

1.72

0.31

Renshen

MOL005357

Gomisin B

31.99

0.60

0.83

Renshen

MOL005360

malkangunin

57.71

0.22

0.63

Renshen

MOL005366

Malvic acid

30.99

1.22

0.15

Renshen

MOL005376

Panaxadiol

33.09

0.82

0.79

Renshen

MOL005384

suchilactone

57.52

0.82

0.56

Renshen

MOL005396

cis-Widdrol alpha-epoxide

69.04

1.07

0.15

Renshen

MOL005399

alexandrin_qt

36.91

1.30

0.75

Renshen

MOL005401

ginsenoside Rg5_qt

39.56

0.88

0.79

Juhong

MOL000358

beta-sitosterol

36.91

1.32

0.75

Juhong

MOL001040

(2R)-5,7-dihydroxy-2-(4-hydroxyphenyl)chroman-4-one

42.36

0.38

0.21

Juhong

MOL001798

neohesperidin_qt

71.17

0.26

0.27

Juhong

MOL001942

isoimperatorin

45.46

0.97

0.23

Juhong

MOL004328

naringenin

59.29

0.28

0.21

Juhong

MOL005849

didymin

38.55

0.60

0.24

Juhong

MOL013331

Isomeranzin

42.78

0.69

0.15

Juhong

MOL013332

Pranferol

38.29

0.54

0.25

Juhong

MOL013352

Obacunone

43.29

0.01

0.77

Tiannanxing

MOL000131

EIC

41.90

1.16

0.14

Tiannanxing

MOL000358

beta-sitosterol

36.91

1.32

0.75

Tiannanxing

MOL000359

sitosterol

36.91

1.32

0.75

Tiannanxing

MOL000432

linolenic acid

45.01

1.21

0.15

Tiannanxing

MOL000449

Stigmasterol

43.83

1.44

0.76

Tiannanxing

MOL000953

CLR

37.87

1.43

0.68

Tiannanxing

MOL001510

24-epicampesterol

37.58

1.43

0.71

Tiannanxing

MOL001641

METHYL LINOLEATE

41.93

1.44

0.17

Tiannanxing

MOL002203

Exceparl M-OL

31.90

1.39

0.16

Tiannanxing

MOL010925

Isooleic acid

33.13

1.15

0.14

Tiannanxing

MOL013131

12,15-Octadecadienoic acid, methyl ester

41.93

1.46

0.17

Tiannanxing

MOL013144

Methyl (6E,9E)-6,9-octadecadienoate

41.93

1.44

0.17

Tiannanxing

MOL013145

Methyl-7,10-octadecadienoate

41.93

1.43

0.17

Tiannanxing

MOL013146

8,11,14-Docosatrienoic acid, methyl ester

43.23

1.53

0.30

Tiannanxing

MOL013156

[(2R)-2-[[[(2R)-2-(benzoylamino)-3-phenylpropanoyl]amino]methyl]-3-phenylpropyl] acetate

38.88

0.35

0.56

Banxia

MOL000131

EIC

41.90

1.16

0.14

Banxia

MOL000358

beta-sitosterol

36.91

1.32

0.75

Banxia

MOL000432

linolenic acid

45.01

1.21

0.15

Banxia

MOL000449

Stigmasterol

43.83

1.44

0.76

Banxia

MOL000519

coniferin

31.11

0.42

0.32

Banxia

MOL000675

oleic acid

33.13

1.17

0.14

Banxia

MOL001755

24-Ethylcholest-4-en-3-one

36.08

1.46

0.76

Banxia

MOL002495

6-shogaol

31.00

1.07

0.14

Banxia

MOL002670

Cavidine

35.64

1.08

0.81

Banxia

MOL002714

baicalein

33.52

0.63

0.21

Banxia

MOL003578

Cycloartenol

38.69

1.53

0.78

Banxia

MOL005030

gondoic acid

30.70

1.20

0.20

Banxia

MOL006936

10,13-eicosadienoic

39.99

1.22

0.20

Banxia

MOL006937

12,13-epoxy-9-hydroxynonadeca-7,10-dienoic acid

42.15

0.18

0.24

Banxia

MOL006944

8-Octadecenoic acid

33.13

1.15

0.14

Banxia

MOL006956

cyclo-(leu-tyr)

111.16

0.16

0.15

Banxia

MOL006957

(3S,6S)-3-(benzyl)-6-(4-hydroxybenzyl)piperazine-2,5-quinone

46.89

0.41

0.27

Zhishi

MOL000006

luteolin

36.16

0.19

0.25

Zhishi

MOL000131

EIC

41.90

1.16

0.14

Zhishi

MOL001798

neohesperidin_qt

71.17

0.26

0.27

Zhishi

MOL001803

Sinensetin

50.56

1.12

0.45

Zhishi

MOL001941

Ammidin

34.55

1.13

0.22

Zhishi

MOL002914

Eriodyctiol (flavanone)

41.35

0.05

0.24

Zhishi

MOL004328

naringenin

59.29

0.28

0.21

Zhishi

MOL005100

5,7-dihydroxy-2-(3-hydroxy-4-methoxyphenyl)chroman-4-one

47.74

0.28

0.27

Zhishi

MOL005828

nobiletin

61.67

1.05

0.52

Zhishi

MOL005849

didymin

38.55

0.60

0.24

Zhishi

MOL007879

Tetramethoxyluteolin

43.68

0.96

0.37

Zhishi

MOL009053

4-[(2S,3R)-5-[(E)-3-hydroxyprop-1-enyl]-7-methoxy-3-methylol-2,3-dihydrobenzofuran-2-yl]-2-methoxy-phenol

50.76

0.03

0.39

Zhishi

MOL013277

Isosinensetin

51.15

1.16

0.44

Zhishi

MOL013279

5,7,4'-Trimethylapigenin

39.83

1.01

0.30

Zhishi

MOL013352

Obacunone

43.29

0.01

0.77

Zhishi

MOL013430

Prangenin

43.60

0.80

0.29

Zhishi

MOL013433

prangenin hydrate

72.63

0.14

0.29

Zhishi

MOL013435

poncimarin

63.62

0.66

0.35

Zhishi

MOL013436

isoponcimarin

63.28

0.50

0.31

Zhishi

MOL013437

6-Methoxy aurapten

31.24

1.01

0.30

Zhishi

MOL013443

isolimonic acid

48.86

0.43

0.18

Zhishi

MOL013445

naringenin-4'-glucoside-7-rutinoside_qt

30.61

0.33

0.16

Gancao

MOL000098

quercetin

46.43

0.05

0.28

Gancao

MOL000211

Mairin

55.38

0.73

0.78

Gancao

MOL000239

Jaranol

50.83

0.61

0.29

Gancao

MOL000354

isorhamnetin

49.60

0.31

0.31

Gancao

MOL000359

sitosterol

36.91

1.32

0.75

Gancao

MOL000392

formononetin

69.67

0.78

0.21

Gancao

MOL000417

Calycosin

47.75

0.52

0.24

Gancao

MOL000422

kaempferol

41.88

0.26

0.24

Gancao

MOL000497

licochalcone a

40.79

0.82

0.29

Gancao

MOL000500

Vestitol

74.66

0.86

0.21

Gancao

MOL001484

Inermine

75.18

0.89

0.54

Gancao

MOL001789

isoliquiritigenin

85.32

0.44

0.15

Gancao

MOL001792

DFV

32.76

0.51

0.18

Gancao

MOL002311

Glycyrol

90.78

0.71

0.67

Gancao

MOL002565

Medicarpin

49.22

1.00

0.34

Gancao

MOL002844

Pinocembrin

64.72

0.61

0.18

Gancao

MOL003656

Lupiwighteone

51.64

0.68

0.37

Gancao

MOL003896

7-Methoxy-2-methyl isoflavone

42.56

1.16

0.20

Gancao

MOL004328

naringenin

59.29

0.28

0.21

Gancao

MOL004805

(2S)-2-[4-hydroxy-3-(3-methylbut-2-enyl)phenyl]-8,8-dimethyl-2,3-dihydropyrano[2,3-f]chromen-4-one

31.79

1.00

0.72

Gancao

MOL004806

euchrenone

30.29

1.09

0.57

Gancao

MOL004808

glyasperin B

65.22

0.47

0.44

Gancao

MOL004810

glyasperin F

75.84

0.43

0.54

Gancao

MOL004811

Glyasperin C

45.56

0.71

0.40

Gancao

MOL004814

Isotrifoliol

31.94

0.53

0.42

Gancao

MOL004815

(E)-1-(2,4-dihydroxyphenyl)-3-(2,2-dimethylchromen-6-yl)prop-2-en-1-one

39.62

0.66

0.35

Gancao

MOL004820

kanzonols W

50.48

0.63

0.52

Gancao

MOL004824

(2S)-6-(2,4-dihydroxyphenyl)-2-(2-hydroxypropan-2-yl)-4-methoxy-2,3-dihydrofuro[3,2-g]chromen-7-one

60.25

0.00

0.63

Gancao

MOL004827

Semilicoisoflavone B

48.78

0.45

0.55

Gancao

MOL004828

Glepidotin A

44.72

0.79

0.35

Gancao

MOL004829

Glepidotin B

64.46

0.46

0.34

Gancao

MOL004833

Phaseolinisoflavan

32.01

1.01

0.45

Gancao

MOL004835

Glypallichalcone

61.60

0.76

0.19

Gancao

MOL004836

echinatin

66.58

0.38

0.17

Gancao

MOL004838

8-(6-hydroxy-2-benzofuranyl)-2,2-dimethyl-5-chromenol

58.44

1.00

0.38

Gancao

MOL004841

Licochalcone B

76.76

0.47

0.19

Gancao

MOL004848

licochalcone G

49.25

0.64

0.32

Gancao

MOL004849

3-(2,4-dihydroxyphenyl)-8-(1,1-dimethylprop-2-enyl)-7-hydroxy-5-methoxy-coumarin

59.62

0.40

0.43

Gancao

MOL004855

Licoricone

63.58

0.53

0.47

Gancao

MOL004856

Gancaonin A

51.08

0.80

0.40

Gancao

MOL004857

Gancaonin B

48.79

0.58

0.45

Gancao

MOL004863

3-(3,4-dihydroxyphenyl)-5,7-dihydroxy-8-(3-methylbut-2-enyl)chromone

66.37

0.52

0.41

Gancao

MOL004864

5,7-dihydroxy-3-(4-methoxyphenyl)-8-(3-methylbut-2-enyl)chromone

30.49

0.90

0.41

Gancao

MOL004866

2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-6-(3-methylbut-2-enyl)chromone

44.15

0.48

0.41

Gancao

MOL004879

Glycyrin

52.61

0.59

0.47

Gancao

MOL004882

Licocoumarone

33.21

0.84

0.36

Gancao

MOL004883

Licoisoflavone

41.61

0.37

0.42

Gancao

MOL004884

Licoisoflavone B

38.93

0.46

0.55

Gancao

MOL004885

licoisoflavanone

52.47

0.39

0.54

Gancao

MOL004891

shinpterocarpin

80.30

1.10

0.73

Gancao

MOL004898

(E)-3-[3,4-dihydroxy-5-(3-methylbut-2-enyl)phenyl]-1-(2,4-dihydroxyphenyl)prop-2-en-1-one

46.27

0.41

0.31

Gancao

MOL004904

licopyranocoumarin

80.36

0.13

0.65

Gancao

MOL004905

3,22-Dihydroxy-11-oxo-delta(12)-oleanene-27-alpha-methoxycarbonyl-29-oic acid

34.32

-0.06

0.55

Gancao

MOL004907

Glyzaglabrin

61.07

0.34

0.35

Gancao

MOL004908

Glabridin

53.25

0.97

0.47

Gancao

MOL004910

Glabranin

52.90

0.97

0.31

Gancao

MOL004911

Glabrene

46.27

0.99

0.44

Gancao

MOL004912

Glabrone

52.51

0.59

0.50

Gancao

MOL004913

1,3-dihydroxy-9-methoxy-6-benzofurano[3,2-c]chromenone

48.14

0.48

0.43

Gancao

MOL004914

1,3-dihydroxy-8,9-dimethoxy-6-benzofurano[3,2-c]chromenone

62.90

0.40

0.53

Gancao

MOL004915

Eurycarpin A

43.28

0.43

0.37

Gancao

MOL004935

Sigmoidin-B

34.88

0.42

0.41

Gancao

MOL004941

(2R)-7-hydroxy-2-(4-hydroxyphenyl)chroman-4-one

71.12

0.41

0.18

Gancao

MOL004945

(2S)-7-hydroxy-2-(4-hydroxyphenyl)-8-(3-methylbut-2-enyl)chroman-4-one

36.57

0.72

0.32

Gancao

MOL004948

Isoglycyrol

44.70

0.91

0.84

Gancao

MOL004949

Isolicoflavonol

45.17

0.54

0.42

Gancao

MOL004957

HMO

38.37

0.79

0.21

Gancao

MOL004959

1-Methoxyphaseollidin

69.98

1.01

0.64

Gancao

MOL004961

Quercetin der

46.45

0.39

0.33

Gancao

MOL004966

3'-Hydroxy-4'-O-Methylglabridin

43.71

1.00

0.57

Gancao

MOL004974

3'-Methoxyglabridin

46.16

0.94

0.57

Gancao

MOL004978

2-[(3R)-8,8-dimethyl-3,4-dihydro-2H-pyrano[6,5-f]chromen-3-yl]-5-methoxyphenol

36.21

1.12

0.52

Gancao

MOL004980

Inflacoumarin A

39.71

0.73

0.33

Gancao

MOL004985

icos-5-enoic acid

30.70

1.22

0.20

Gancao

MOL004988

Kanzonol F

32.47

1.18

0.89

Gancao

MOL004989

6-prenylated eriodictyol

39.22

0.40

0.41

Gancao

MOL004990

7,2',4'-trihydroxy-5-methoxy-3-arylcoumarin

83.71

0.24

0.27

Gancao

MOL004991

7-Acetoxy-2-methylisoflavone

38.92

0.74

0.26

Gancao

MOL004993

8-prenylated eriodictyol

53.79

0.43

0.40

Gancao

MOL004996

gadelaidic acid

30.70

1.20

0.20

Gancao

MOL005000

Gancaonin G

60.44

0.78

0.39

Gancao

MOL005001

Gancaonin H

50.10

0.60

0.78

Gancao

MOL005003

Licoagrocarpin

58.81

1.23

0.58

Gancao

MOL005007

Glyasperins M

72.67

0.49

0.59

Gancao

MOL005008

Glycyrrhiza flavonol A

41.28

-0.09

0.60

Gancao

MOL005012

Licoagroisoflavone

57.28

0.71

0.49

Gancao

MOL005016

Odoratin

49.95

0.42

0.30

Gancao

MOL005017

Phaseol

78.77

0.76

0.58

Gancao

MOL005018

Xambioona

54.85

1.09

0.87

Gancao

MOL005020

dehydroglyasperins C

53.82

0.68

0.37

Shengjiang

MOL000358

beta-sitosterol

36.91

1.32

0.75

Shengjiang

MOL002467

6-gingerol

35.64

0.54

0.16

Shengjiang

MOL002495

6-shogaol

31.00

1.07

0.14

Shengjiang

MOL006129

6-methylgingediacetate2

48.73

0.55

0.32