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. 2023 Jan 3;12(1):113. doi: 10.3390/antiox12010113

Table 4.

Compounds with biological activity identified in O. robusta extract in negative ion mode.

Compound Formula Adduct m/z Retention Time (min)
Lactones
D-Glucaro-1,4-lactone C6H8O7 M-H 191.0223 1.616
Cinnamic acids and derivatives
1-O-Sinapoylglucose C17H22O10 M-H 385.1205 11.743
Benzene and derivatives
Vanillic acid C8H8O4 M-H 167.0382 7.284
2-O-Galloyl-1,4-galactarolactone C13H12O11 M+K-2H 380.9824 21.898
Carboxylic acids and derivatives
2-O-Caffeoylhydroxycitric acid C15H14O11 M+Na-2H 391.0282 1.486
Organooxygen compounds
Cis-5-Caffeoylquinic acid C16H18O9 M+K-2H 391.0376 1.099
trans-o-Coumaric acid 2-glucoside C15H18O8 M+H-H2O 309.0968 6.176
trans-p-Coumaric acid 4-glucoside C15H18O8 M+H-H2O 309.0969 6.176
6-Caffeoylsucrose C21H28O14 M-H 503.138 7.902
Gentiobiosyl 2-methyl-6-oxo-2E,4E-heptadienoate C20H30O13 M-H 477.159 9.398
Glucocaffeic acid C15H18O9 M-H 341.0926 10.455
Coumarins and derivatives
Rutaretin 9-rutinoside C26H34O14 M+FA-H 615.202 6.665
Fatty acyls
1-Hexanol arabinosylglucoside C17H32O10 M+Na-2H 417.171 7.902
Flavonoids
Hesperetin 5-O-glucoside C22H24O11 M-H 463.1337 9.038
Phenol lipids
Caryoptosidic acid C16H24O11 M-H2O-H 373.119 9.578
Hydroxyisonobilin C20H26O6 M-H 361.1717 17.079
Furanoid lignans
Divanillyltetrahydrofuran ferulate C30H32O8 M+FA-H 565.197 16.022
Phenols
5-Hydroxyconiferyl alcohol C10H12O4 M-H 195.0701 16.382
Betalains
Betalamic acid C9H9NO5 2M-H 211.0525 4.321
Vulgaxanthin I C14H17N3O7 M+FA-H 384.1014 6.744
Betanin C24H26N2O13 2M-H 1099.287 7.852
Betalamic acid C9H9NO5 M-H2O-H 192.0344 8.909