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Table 1 Chemical profile of bioactive compounds present in B. strigosa extract using UPLC–ESI–QTOF–MS analysis

From: UPLC–ESI–QTOF–MS profiling, antioxidant, antidiabetic, antibacterial, anti-inflammatory, antiproliferative activities and in silico molecular docking analysis of Barleria strigosa

No

RT (min)

Mass (m/z)

Molecular formular

DB Diff (ppm)

Tentative compound identity

1

1.759

126.0315

C6H6O3

1.89

Larixinic acid

2

1.763

366.0745

C20H14O7

−1.51

Daphnoretin methyl ether

3

1.923

295.1066

C14H17NO6

−3.46

Sambunigrin

4

1.930

143.0951

C7H13NO2

−3.16

3β,6β-Dihydroxynortropane

5

5.407

364.1369

C15H24O10

0.13

Dihydrocatalpol

6

11.339

338.1003

C16H18O8

0.30

Hydrojuglone glucoside

7

12.155

224.0683

C11H12O5

0.64

5-(3',4',5'-Trihydroxyphenyl)-gammavalerolactone

8

12.349

314.1001

C14H18O8

0.20

Alopecuquinone

9

12.714

484.3035

C26H44O8

0.23

Goshonoside F2

10

13.147

644.3401

C32H52O13

1.01

Goshonoside F3

11

13.239

284.1258

C14H20O6

0.59

2-Phenylethyl beta-D-glucopyranoside

12

14.273

336.23

C20H32O4

0.31

16,17-Dihydroxy-16beta-(L)-kauran-19-oic acid

13

16.12

595.1661

C27H31O15

0.31

Pelargonidin 3,7-di-glucoside

14

16.141

608.1379

C27H28O16

−0.32

6''-(4-Carboxy-3-hydroxy-3-methylbutanoyl)hyperin

15

16.142

462.0795

C21H18O12

0.70

3-Methylellagic acid 8-rhamnoside

16

16.151

510.1734

C24H30O12

0.56

Plumerubroside

17

16.295

194.0578

C10H10O4

0.49

Isoferulic acid

18

16.569

370.1993

C19H30O7

−0.29

(3S,7E,9S)-9-Hydroxy-4,7-megastigmadien3-one 9-glucoside

19

16.57

208.1462

C13H20O2

0.69

(5α,8β,9β)-5,9-Epoxy-3,6-megastigmadien-8-ol

20

16.726

504.27

C28H40O8

4.59

Ixocarpalactone A

21

16.733

499.3142

C26H45NO8

0.54

18-O-Methyldelterine

22

16.780

372.215

C19H32O7

−0.54

Icariside B9

23

16.789

192.1512

C13H20O

1.33

2,4-Diisopropyl-3-methylphenol

24

16.811

512.2626

C26H40O10

−0.97

Andrographoside

25

16.848

468.1634

C22H28O11

−0.44

Prim-O-glucosylcimifugin

26

16.892

530.2725

C26H42O11

0.34

Cinncassiol D2 glucoside

27

16.975

386.1938

C19H30O8

0.79

Roseoside

28

17.008

328.1154

C15H20O8

1.30

Androsin

29

17.008

490.1451

C24H26O11

4.97

Andrographidine E

30

17.009

936.3257

C44H56O22

0.63

Epimedokoreanoside I

31

17.010

468.1629

C22H28O11

0.65

6-O-p-Hydroxybenzoyl ajugol

32

17.046

402.1887

C19H30O9

0.60

Spionoside B

33

17.055

358.090

C15H18O10

−0.05

Dihydrocaffeic acid 3-O-glucuronide

34

17.063

524.2259

C26H36O11

−0.35

(8R,8'R)-Secoisolariciresinol 9-glucoside

35

17.121

286.2297

C20H30O

−0.19

( +)-Totarol

36

17.122

650.3277

C34H50O12

3.91

Thapsigargin

37

17.122

666.2938

C39H42N2O8

0.48

Thalphinine

38

17.123

628.3457

C32H52O12

0.35

Ecdysterone-3-O-beta-D-glucopyranoside

39

17.187

498.1373

C22H26O13

0.02

Verproside

40

17.196

422.2154

C19H34O10

−0.58

1-Octen-3-ol-3-o-beta-D-xylopyranosyl(1- > 6)-beta-D-glucopyranoside

41

17.272

642.3247

C32H50O13

0.64

Steviobioside

42

17.287

494.1788

C24H30O11

0.11

Harpagoside

43

17.329

498.283

C26H42O9

−0.20

Isodopharicin F

44

17.340

482.1424

C22H26O12

−0.01

Catalposide

45

17.342

368.1473

C18H24O8

−0.60

Methyl (R)-9-hydroxy-10-undecene-5,7-diynoate glucoside

46

17.343

342.095

C15H18O9

0.30

Glucocaffeic acid

47

17.343

148.0526

C9H8O2

−0.97

E-Cinnamic acid

48

17.367

634.3327

C34H50O11

4.09

(3b,20R,22R)-3,20,27-Trihydroxy-1-oxowitha-5,24-dienolide 3-glucoside

49

17.438

536.2596

C28H40O10

4.79

7β-Hydroxy-7-desacetoxykhivorinic acid, methyl ester

50

17.439

514.2779

C26H42O10

−0.17

Cofaryloside

51

17.548

348.1937

C20H28O5

−0.09

Longikaurin A

52

17.597

512.1531

C23H28O13

−0.12

3-(4-Hydroxy-3-methoxyphenyl)-1,2-propanediol 2-O-(galloyl-glucoside)

53

17.669

292.1164

C12H20O8

−1.84

Pantoyllactone glucoside

54

17.670

426.2408

C26H34O5

−0.30

Dihydro-7-desacetyldeoxygedunin

55

17.670

316.204

C20H28O3

−0.53

Lagaspholones A

56

17.671

462.2621

C26H38O7

−0.84

10-Desacetyltaxuyunnanin C

57

17.743

630.3607

C32H54O12

1.37

Lyciumoside I

58

17.764

458.247

C30H34O4

−2.79

Sophoranochromene

59

17.789

572.3095

C31H44N2O8

0.43

Isodelectine

60

17.867

480.1631

C23H28O11

0.04

Albiflorin R1

61

17.904

332.1989

C20H28O4

−0.28

Hautriwaic acid

62

17.911

756.3551

C37H56O16

2.30

Rhodexin D

63

17.935

348.1934

C20H28O5

0.65

Novaxenicins A

64

18.011

660.2757

C34H44O13

3.80

Taccalonolide J

65

18.114

316.2041

C20H28O3

−0.79

Lagaspholones A

66

18.123

1572.759

C76 H116 O34

−15.36

Protocrocin

67

18.124

282.1979

C20H26O

1.82

Juvocimene 1

68

18.128

492.2366

C26H36O9

−1.33

Caryoptin

69

18.160

560.3347

C32H48O8

0.39

Dihydroisocucurbitacin-beta-25-acetate

70

18.203

708.3326

C36H52O14

4.42

Scillipheosidin 3-[glucosyl-(1- > 2)-rhamnoside]

71

18.252

548.2626

C29H40O10

−0.82

Archangelolide

72

18.273

506.216

C26H34O10

−1.66

Massonianoside C

73

18.481

479.2877

C26H41NO7

1.31

Delbruline

74

18.445

564.291

C30H44O10

4.39

Strophanthidin-beta-D-digitaloside

75

18.446

346.1779

C20H26O5

0.34

Rabdoserrin A

76

18.642

478.2209

C25H34O9

−1.31

Simalikilactone D

77

18.751

552.185

C26H32O13

−1.26

Durantoside I

78

18.926

544.3399

C32H48O7

0.20

Hovenidulcigenin A

79

19.321

474.2255

C26H34O8

−0.35

Nigakilactone G

80

20.296

623.4035

C34H57NO9

−0.22

Pingbeidinoside

81

21.243

576.1262

C30H24O12

0.93

Epicatechin-(2beta- > 5,4beta- > 6)-entepicatechin

82

21.293

310.1571

C20H22O3

−0.53

2,3-Dehydrosalvipisone