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. 2020 Jul 31;25(15):3495. doi: 10.3390/molecules25153495

Table 1.

Content (mg/100 g d.w.) and composition of tentatively identified polyphenols in wild Brassica spp. used in this investigation.

# UV λmax (nm) [M + H]+/ [M − H]- MS2 (m/z) (%) Compound a B.incana B. macrocarpa B. rupestris B. villosa
BN BW BB BU5 BU9 BU15 BL BX BY5 DC
1 235, 263, 319 951/949 625(100); 301(5) Q-3-O-diglucoside-
7-O-diglucoside
2.3 ± 0.0 9.6 ± 0.1 18.1 ± 0.1 6.0 ± 0.4 69.2 ± 10.7 2.5 ± 0.02 13.0 ± 0.2 3.6 ± 0.3 5.7 ± 0.6 6.6 ± 0.0
2 239, 263, 338 935/933 701(100); 285(2) K-3-O-triglucoside-
7-O-glucoside
51.2 ± 1.9 3.3 ± 0.5 23.7 ± 6.6 - - - 50.2 ± 3.1 46.9 ± 2.7 80.4 ± 8.6 66.9 ± 3.1
3 237, 255, 330 1275/1273 1111(100); 949(43); 787(68); 301(1) Q-3-O-caffeoyltriglucoside-
7-O-diglucoside
- - - 15.1 ± 1.1 59.8 ± 9.1 18.8 ± 7.4 - - - -
4 239, 267, 331 1127/1125 801(100); 609(27); 285(1) K-3-O-hydroxyferuloyl
diglucoside-7-O-diglucoside
52.3 ± 1.9 99.7 ± 1.3 - - - - - - - -
5 235, 263, 330 935/933 609(100);285(2) K-3-O-diglucoside-
7-O-diglucoside
- - 28.1 ± 1.9 - - - 52.9 ± 3.0 36.0 ± 2.2 16.3 ± 2.0 50.1 ± 1.3
6 239, 267, 331 995/993 831(100); 787(88); 625(56); 301(1) Q-3-O-sinapoyldiglucoside-
7-O-glucoside
- - - - - - 16.5 ± 0.5 9.1 ± 1.2 21.2 ± 2.1 30.7 ± 0.1
7 243, 267, 331 1097/1095 771(100); 609(17) K-3-O-caffeoyldiglucoside-
7-O-diglucoside
62.5 ± 2.1 43.5 ± 2.2 - - - - - - - -
8 245, 340 1319/1317 1111(100); 993(72); 787(87); 301(2) Q-3-O-sinapoyltriglucoside-
7-O-diglucoside
- - - 54.0 ± 2.3 73.7 ± 9.6 12.5 ± 0.0 - - - -
9 237, 339 1157/1155 949(100); 831(32); 625(35); 301(1) Q-3-O-sinapoyldiglucoside-
7-O-diglucoside
- - - - - - 76.1 ± 2.4 38.9 ± 2.4 17.7 ± 2.6 11.6 ± 0.5
10 235, 340 951/949 787(100); 625(52); 301(18) Q-3-O-caffeoyldiglucoside-
7-O-glucoside
- - 9.2 ± 0.6 - - - - - - -
11 253, 347 1289/1287 1111(93); 963(75); 787(100); 301(1) K-3-O-feruloyltriglucoside-
7-O-diglucoside
- - - 45.4 ± 12.3 62.1 ± 9.3 74.8 ± 0.2 - - - -
12 239, 267, 331 979/977 815(100); 771(2); 609(7); 285(2) K-3-O-sinapoyldiglucoside-
7-O-glucoside
27.7 ± 0.3 28.2 ± 0.7 7.0 ± 0.1 - - - 40.0 ± 1.3 86.1 ± 6.1 24.8 ± 3.7 31.3 ± 0.6
13 239, 267, 330 1303/1301 1095(7); 977(100); 771(75); 285(2) K-3-O-sinapoyltriglucoside-
7-O-diglucoside
- - - 62.0 ± 2.2 19.5 ± 2.9 36.7 ± 0.4 - - - -
14 243, 267, 331 1141/1139 815(100); 609(28); 285(1) K-3-O-sinapoyldiglucoside-
7-O-diglucoside
81.3 ± 1.8 67.5 ± 0.7 7.7 ± 0.4 - - - 27.1 ± 0.9 81.4 ± 4.4 37.1 ± 3.9 25.8 ± 1.3
15 239, 264, 331 949/947 785(100); 609(7); 285(2) K-3-O-feruloyldiglucoside-
7-O-glucoside
- - - - - - 21.5 ± 0.6 10.1 ± 1.2 43.3 ± 4.2 32.1 ± 0.1
16 239, 267, 331 1111/1109 785(100); 609(21); 285(1) K-3-O-feruloyldiglucoside-
7-O-diglucoside
38.5 ± 1.1 25.3 ± 1.5 - - - - 34.3 ± 1.5 30.9 ± 1.9 30.6 ± 3.0 42.3 ± 0.2
17 239, 265, 332 1273/1271 1095(10); 947(100); 771(64); 285(3) K-3-O-feruloyltriglucoside-
7-O-diglucoside
- - - 19.5 ± 0.1 26.2 ± 4.0 16.7 ± 0.1 - - - -
18 239, 263, 343 935/933 771(100); 609(10); 285(5) K-3-O-caffeoyldiglucoside-
7-O-glucoside
- - - 29.4 ± 0.3 39.0 ± 5.8 18.6 ± 0.3 - - - -
19 239, 253, 353 965/963 801(100); 625(9); 301(3) Q-3-O-feruloyldiglucoside-
7-O-glucoside
- - - 12.6 ± 0.1 31.9 ± 4.8 10.6 ± 0.2 - - - -
20 239, 269 sh, 329 1495/1493 1169(100); 609(39); 285(7) K-3-O-sinapoylhydroxyferuloyl triglucoside-7-O-diglucoside 10.4 ± 0.3 20.0 ± 2.1 - 19.1 ± 0.2 20.0 ± 2.9 11.1 ± 0.0 - - - -
21 239, 269 sh, 330 1465/1463 1139(100); 609(21); 285(3) K-3-O-feruloylhydroxyferuloyl triglucoside-7-O-diglucoside 5.6 ± 0.2 31.3 ± 2.7 30.7 ± 1.8 - - - - - - -
22 239, 267, 331 1509/1507 1301(7); 1183(100); 609(27); 285(5) K-3-O-disinapoyltriglucoside-
7-O-diglucoside
22.4 ± 1.3 53.0 ± 2.7 18.2 ± 1.5 18.9 ± 0.3 24.0 ± 3.8 16.2 ± 1.8 - - - -
23 239, 267 sh, 327 1479/1477 1153(100); 947(25); 609(33); 285(4) K-3-O-feruloylsinapoyl
triglucoside-7-O-diglucoside
16.6 ± 0.4 37.7 ± 3.0 10.9 ± 1.3 - - - - - - -
24 240, 331 777 b/753 529(100) 1,2-disinapoyl gentiobioside 57.2 ± 0.0 51.3 ± 2.4 - - - - 27.8 ± 0.7 50.6 ± 2.4 39.4 ± 3.7 17.1 ± 0.2
25 240, 327 747 b/723 529(38); 499(100) 1-sinapoyl-2-feruloyl gentiobioside 55.6 ± 0.7 55.6 ± 1.3 - - - - 15.5 ± 0.1 36.9 ± 3.6 48.7 ± 3.9 33.3 ± 0.7
26 239, 294 sh, 327 717 b/693 499(100) 1,2-diferuloyl gentiobioside 9.0 ± 0.0 1.6 ± 0.8 - - - - 0.94 ± 0.0 0.7 ± 0.0 45.4 ± 4.2 32.4 ± 0.8
27 240, 327 983 b/959 735(100); 511(21) 1,2,2′-trisinapoyl gentiobioside 20.9 ± 0.7 5.4 ± 1.2 8.9 ± 0.7 34.5 ± 0.5 28.1 ± 4.0 18.3 ± 0.3 55.1 ± 3.2 19.5 ± 0.9 45.7 ± 4.2 66.3 ± 1.8
28 239, 327 953 b/929 735(98); 705(100); 511(13); 481(7) 1,2′-disinapoyl-2-feruloyl gentiobioside 14.8 ± 0.1 0.98 ± 0.0 1.3 ± 0.1 3.4 ± 0.04 7.6 ± 1.1 0.75 ± 0.0 33.7 ± 0.5 12.8 ± 2.5 8.3 ± 0.7 5.2 ± 0.5

aK, kaempferol; Q, quercetin. b[M + Na]+ for gentiobiosides.