Table 3 Summary of the main compounds in the methanolic crude extracts from O. indicum stems, Z. zerumbet rhizomes, and P. Amarus stems using the LC-QTOF-MS/MS [M − H]–.

From: Hybridisation of in silico and in vitro bioassays for studying the activation of Nrf2 by natural compounds

Peak no.

Rt (min)

Compounds

Observed precursor ion (m/z)

Fragment (m/z)

Calculated precursor ion (m/z)

O. indicum stems

 

1

10.97

Forsythiaside

623.1940

461.1616; 297.0972; 315.1027

623.1970

2

11.18

Scutellarin

461.0720

285.0407; 462.0768; 483.0547

461.0720

3

11.49

Leucosceptoside A

637.2115

461.1636; 175.3081

637.2131

4

12.29

Baicalin

445.0768

891.1605; 269.0407

445.0771

5

12.81

Oroxylin A-7-O-β-D-glucuronide

459.0921

283.0615; 268.035; 919.1915

459.0927

6

12.89

Chrysin derivative

429.0833

253.0516

-

Z. zerumbet rhizomes

 

1

12.26

Kaempferol-3-O-rhamnoside

431.0981

285.0406, 255.0285, 227.0336

431.0978

2

13.29

Kaempferol 3-(2″-acetylrhamnosid) or Kaempferol 3-(3″-acetylrhamnosid)

473.109

285.0399,

255.0284,

227.0336

473.1084

3

14.30

Kaempferol 3-(2″,4″-diacetylrhamnosid) or Kaempferol 3-(3″,4″-diacetylrhamnosid)

515.1189

285.0371, 255.0287, 227.0340

515.1190

4

15.82

Cirsimaritin

313.0712

298.0487, 283.0250, 256.0321

313.0712

P. amarus stems

 

1

9.44

Brevifolincarboxylic acid

291.0156

247.0257

291.0141

2

9.81

Corilagin

633.0721

300.9959, 275.0183

633.0728

3

10.78

Methyl brevifolincarboxylate

305.0311

273.0053

305.0297