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. 2023 Jul 3;13:10714. doi: 10.1038/s41598-023-37830-6

Table 1.

Compounds detected in the ethanolic extracts of then Peruvian Mentheae by LC-HRMS.

No peak Assignment Rt [M–H] Experimental mass Δ (ppm) Fragments Detected in* References
1 Quinic acid 1.33 C7H11O6 191.0559 1.57 127.0394 Cb, So, Mm, Sc, Cr, Cs, Cp 23
2 Malic acid 1.36 C4H5O5 133.0139 1.5 Ss, Sc, 23
3 Quinic acid isomer 1.44 C7H11O6 191.0560 2.09 127.8695 Cb, Mm, Cr, Cs, Cp 23
4 Citric acid 1.77 C6H7O7 191.0196 2.09 111.0081 So 23
5 Pyroglutamic acid 1.87 C5H6O3N 128.0348 0.00 Sh 23
6 Succinic acid 1.98 C4H5O4 117.0187 0.85 So, Mm, Ss, Sc, Cr, Cs, Sh, Hm 23
7 Monoacetylglycerol 2.09 C5H9O4 133.0502 0.75 Ss
8 Mesaconic acid 2.96 C5H5O4 129.0190 1.55 Cp
9 3,4-dihydroxyphenyl lactic acid “danshensu” 4.05 C9H9O5 197.0454 2.02 123.0445, 135.0446, 179.0346 So, Cb, So, Mm, Sc, Cr, Cs, Hm, Sh 24,25
10 Protocatechuic acid 4.64 C7H5O4 153.0190 1.31 109.0289, 135.0448 So, Sc, Hm, Cp 24
11 1-O-Caffeoylquinic acid 6.39 C16H17O9 353.0883 2.83 135.0447, 179.0347, 191.0559 Mm 58,59,5860
12 Protocatechuic aldehyde 7.73 C7H5O3 137.0239 0.00 109.0289 Cb, So, Mm, Ss, Cr, Cs, Sh, Hm, Cp 24
13 Hydroxyheptandioic acid 8.78 C7H11O5 175.0611 2.28 So, Ss
14 p-Coumaroyl quinic acid 8.83 C16H17O8 337.0934 2.96 119.0496, 163.0398, 173.0453, 191.0559 Mm 58,59,5860
15 3-O-Caffeoylquinic acid 8.99 C16H17O9 353.0883 2.83 173.0453, 179.0559, 191.056 Mm, Cr 58,59,5860
16 Caffeic acid O-hexoside 9.02 C15H17O9 341.0883 2.93 179.0347, 233.0458, 251.0564, 281.0670 So, Ss, Sc 60,41
17 p-Coumaric acid 9.28 C9H7O3 163.0399 2.45 119.0497 Ss 38
18 5-O-Caffeoylquinic acid 9.41 C16H17O9 353.0883 2.83 135.0446, 179.0346, 191.055 Cb, So, Mm, Cr, Hm, Cp 58,59,5860
19 Eucomic acid 9.54 C11H11O6 239.0561 2.09 195.0660, 178.0586 Cb
20 Caffeic acid 9.64 C9H7O4 179.0348 1.67 135.0446, 161.0446 So, Mm, Ss, Sc, Cr, Cs, Sh, 38,39,41
21 Caffeic acid O-hexoside 9.77 C15H17O9 341.088 2.05 179.0345, 235.0453, 251.0561, 281.0667 Sc 60,41
22 Tuberonic acid hexoside 9.86 C18H27O9 387.1665 2.58 101.5668, 163.0033, 206.9725 So, Ss, Cr, Sh 23
23 p-Coumaroylquinic acid isomer 10.1 C16H17O8 337.0934 2.97 163.0397, 173.0454 So, Mm 58,59,61,27
24 Salvianic acid C 10.21 C18H17O9 377.0882 2.39 161.0240, 179.0347, 359.0776 Cr 41
25 p-Coumaroyl hexoside 10.38 C15H17O8 325.0930 1.85 119.0496, 163.0396 Sc 60
26 Feruloylquinic acid 10.38 C17H19O9 367.1040 3.0 149.0240, 191.0560, 193.0504, 173.0453 Mm 20,27
27 Quercetin 3,7-di-O-hexoside 10.43 C27H29O17 625.1407 0.32 121.0288, 179.0346, 273.0980, 301.0354, 303.1084, 463.0882, Cs, Cp 62,29,30
28 4-O-Caffeoylquinic acid 10.45 C16H17O9 353.0880 1.12 135.0445, 179.0345, 191.0557 Sc 58,59,5860
29 p-Coumaroyl hexoside 10.59 C15H17O8 325.0930 1.85 119.0496, 163.0396 Sc 60
30 Salvianic acid C isomer 10.67 C18H17O9 377.0881 2.12 197.0453, 347.1708, 359.0775 Cr 41
31 Tuberonic acid 10.67 C12H17O4 225.1132 2.22 134.8648, 146.9382, 168.8359, 187.9417, 213.0961 Mm, Sh, 23
32 Quercetin O-rutinoside 10.78 C27H29O16 609.1458 0.33 121.0289, 179.0345, 301.0356, 273.0881 Mm, Cp 60,29,30,35
33 Eriodictyol O-rutinosise 10.89 C27H31O15 595.1661 0.34 151.0397, 287.0562 Cs, Sh, Hm 42,29,30
34 Luteolin O-rutinoside 11.00 C27H29O15 593.1504 0.51 285.0403, 447.0928 Cb, Sc, Cr, Cp 16,63,26
35 Apigenin O-rutinoside 11.01 C27H29O14 577.1556 0.35 269.1030 Sc, Cr 16,38,63,26
36 Kaempferol O-hexoside 11.02 C21H19O11 447.0936 1.78 151.0031, 285.0406, Cb, Ss, Cs 20,29,30
37 Quercetin O-hexoside 11.02 C21H19O12 463.0886 1.94 301.0358 So, Mm, Ss, Sc, Cp 60,44,29,30
38 Quercetin O-glucuronide 11.09 C21H17O13 477.0679 2.1 301.0356 So, Ss 44,29,30
39 Feruloyl hexoside 11.12 C16H19O9 355.1036 1.97 149.0240, 193.0502 Sc 60
40 Pentahydroxy-methoxyflavone hexoside 11.12 C22H21O13 493.0989 1.42 162.8387, 163.0397, 331.0827, 315.1089 Cs 29,30
41 Isorhamnetin O-hexoside 11.23 C22H21O12 477.1046 2.72 315.0824, 357.0352, 462.0768 Ss 43,29,30
42 Naringenin O- rutinoside 11.33 C27H31O14 579.1714 0.00 151.0030, 271.0612 Mm, Cb, Cs, Hm, Cp 29,30
43 Eriodictyol O- rutinoside 11.4 C27H31O15 595.1665 0.34 151.0033, 287.0564 Cs 29,30
44 Luteolin O-glucuronide 11.56 C21H17O12 461.0729 1.95 133.0290, 151.0395, 285.0407, So, Ss, Cr, Sh 44,29,30
45 Luteolin O-hexoside 11.57 C21H19O11 447.0937 2.01 151.0398, 241.1084, 285.0407 Mm, Cr 60,29,30
46 Dihydrobaicalin 11.57 C21H19O11 447.0936 1.79 271.0250, 403.1613 Sc 62
47 Sagerinic acid 11.58 C36H31O16 719.1600 1.67 161.0239, 179.0348, 359.0715, 539.1186 Sc, Cr 38,39,4547
48 Hesperetin 7-O-rutinoside 11.64 C28H33O15 609.1819 0.16 151.0397, 179.0347, 301.0718, 257.1035 Mm, Cb, Hm, Cp 29,30,64
49 Apigenin O-rutinoside 11.66 C27H29O14 577.1557 0.17 225.1129, 269.0453 Cr 29,30
50 Dimethylrosmarinic acid 11.67 C20H19O8 387.1091 2.84 179.0347, 135.0447, 161.0452 So, Sh
51 Isorhamnetin 3-O-glucuronide 11.7 C22H19O13 491.0834 1.62 151.0396, 179.0346, 302.0388, 300.0602, 301.0358, 299.0565, 315.0513 So 29,30
52 Salvianolic acid A isomer 11.75 C26H21O10 493.1142 1.42 179.0344, 197.0450, 269.0821, 295.1192, 313.0723, 359.0778 Cs 24,25,41,49
53 Tetrahydroxy-methoxyflavone O-hexoside 11.78 C22H21O12 477.1041 1.68 162.8398, 163.8391, 315.1451 Cr 29,30
54 Trihydroxymethoxyflavone O-hexoside 11.89 C22H21O11 461.1093 1.95 299.0559 Sh, 29,30
55 Salvianolic acid B isomer 11.99 C36H29O16 717.1443 1.81 321.0616, 519.0945 Cs 25,40,41,47,48
56 Apigenin C-hexoside 12.01 C21H19O10 431.0984 0.00 269.0452, 281.1024, 311.1130, 341.1960, 371.1002 Cr 20
57 Rosmarinic acid 12.04 C18H15O8 359.0775 2.23 161.0240, 179.0345, 197.0452 Cb, So, Mm, Ss, Sc, Cr, Cs, Sh, Hm, Cp 25,38,39,45,46,48
58 Luteolin C-hexoside 12.07 C21H19O11 447.0934 2.91 285.0404, 297.1353, 357.1921, 387.1160 Cr 20
59 Dicaffeoylquinic acid 12.17 C25H23O12 515.1194 0.19 135.0444, 161.0238, 179.0345, 353.0881 Cr 58,59,5860
60 Salvianolic acid B isomer 12.53 C36H29O16 717.1443 1.81 295.0611, 321.0408, 339.0512, 493.1137, 519.0930, 537.1024 Cb, Ss, Hm 25,40,41,47,48
61 Luteolin O-acetylhexoside 12.71 C23H21O12 489.1039 1.23 133.0289, 151.0395, 241.0537, 257.1035, 267.0667, 285.0404, 447.0935 Cr 63,26
62 Artemetin 12.8 C20H19O8 387.1089 2.32 327.1241, 342.1067, 357.0992, 372.1184 Sh, 29,30
63 Isorinic acid 12.95 C18H15O7 343.0827 2.62 161.0241, 327.2181 Cb, Ss, Sc Hm 41,65
64 Lithospermic acid 13.03 C27H21O12 537.1038 0.93 295.0610, 493.1147 Cs 24,41
65 Isosakuranetin O-rutinoside 13.15 C28H33O14 593.1874 0.51 285.0770, 594.1905 Mm, Cp 29,30
66 Methyl rosmarinate 13.28 C19H17O8 373.0935 2.95 179.0347, 194.0540, 359.0778 Sc 20,25,38
67 Quercetin O-(p-coumaroyl)-hexoside 13.51 C30H25O14 609.1242 0.49 301.0719, 447.0940, 462.0747, 594.1343 Cr 29,30
68 Eriodictyol 13.6 C15H11O6 287.0563 2.44 107.0133, 135.0445, 151.0030 Cb, Cp 29,30
69 Luteolin 13.62 C15H9O6 285.0408 3.16 133.0289, 151.0032, 241.1085 Cb, Hm 29,30,32
70 Dihydrophilonotisflavone 13.63 C30H19O12 571.0883 1.05 133.0290, 151.0033, 285.0410, 286.0441 So, Ss 29,30
71 Ferulic acid 13.68 C10H9O4 193.0504 1.55 134.0367, 149.0239, 178.0220 Sc 20,25,66
72 Salvianolic acid A isomer 13.87 C26H21O10 493.1141 1.22 159.8595, 179.0345, 197.0451, 295.0612, 269.0821, 313.0719, 359.0774 Cs, Cp 24,25,41,49
73 Protocatechuic acid O-(hydroxybenzoyl)hexoside 13.94 C20H19O11 435.0935 1.61 137.0239, 153.0191, 297.1346, 315.1452 Cr
74 Trihydroxy-methoxyflavone 14.00 C16H11O6 299.0565 3.01 151.0397, 255.0698, 285.0413 Ss, Sh 29,30,32,35
75 Hesperetin O-hexoside 14.27 C22H23O11 463.1250 2.06 151.0395, 179.0347, 301.0720 Cp 29,30,34
76 Caffeic acid ethyl ester 14.66 C11H11O4 207.0661 1.44 179.0347 Cb, Sc
77 Quercetin 14.97 C15H9O7 301.0356 2.33 273.0407, 257.8189, 179.0346, 151.0392, 121.0288 Sc 67,29,30
78 Caffeic acid dimethyl derivative 15.01 C11H11O4 207.0661 1.45 16,931.0239, 151.940396, 147.069552 Cs
79 Salvianolic acid F isomer 15.46 C17H13O6 313.0721 2.88 269.082196, 15,979.0656 Sc, Cs 41
80 Dimethylquercetin 15.49 C17H13O7 329.0673 3.34 314.0756, 301.0716, 179.0347, 151.0396, 121.0288 Cb 29,30
81 Trihydroxy-dimethoxyflavone 15.53 C17H13O7 329.0672 3.04 151.0398, 201.8020, 257.8197, 283.0612, 299.0201, 313.0722, 314.0754 Mm 29,30
82 Trihydroxylinoleic acid 16.03 C18H31O5 327.2183 2.75 269.0457 Cb, Mm, Ss, Sc, Hm
83 Ethyl caffeate 16.14 C11H11O4 207.0660 0.97 179.0346 Ss
84 Apigenin 16.15 C15H9O5 269.0459 3.35 151.0396, 117.0187 Ss, Sc, Cr 40,67,29,30,32
85 Naringenin 16.39 C15H11O5 271.0616 3.32 151.0397, 177.0190 Ss, Cp 68,29,30
86 Salvianolic acid F isomer 16.87 C17H13O6 313.0719 2.23 269.0822, 159.0658 Sc 41
87 Ethyl rosmarinate 17.23 C20H19O8 387.1088 2.07 179.0344, 206.9724, 359.0777 Cb 20,38,39
88 Dimethylquercetin 17.59 C17H13O7 329.0673 3.34 121.0291, 151.0397, 179.0350, 301.0715, 314.0756 Ss, Cp 66,29,30
89 Hesperetin 17.66 C16H13O6 301.0722 3.32 151.0032, 179.0343, 286.0495 Cp 29,30,34
90 Salvianolic acid F isomer 17.87 C17H13O6 313.0721 2.87 159.0448, 269.0821 Cs 41
91 15,16-epoxi-10S-hidroxicleroda-3,7,13(16),14 tetraeno-17, 12S; 18,19 diolido 17.94 C20H19O6 355.1190 2.25 311.1291 Sh 55
92 Trihydroxyoleic acid 18.13 C18H33O5 329.2336 2.43 171.0195, 224.7632, 250.1448 Mm, Cb Cs 37
93 Hydroxyhexadecandioic acid 18.63 C16H29O5 301.2025 3.32 Cs 37
94 Trihydroxy-trimethoxyflavone 18.73 C18H15O8 359.0766 0.28 301.6655, 314.2232, 329.0299, 344.0546 Mm, Cb, Cp
95 Trihydroxy-methoxyflavanone (hesperetin isomer) 19.15 C16H13O6 301.0721 2.87 161.0240, 139.0032 Cp 28,30
96 trihydroxymethoxyflavone 19.23 C16H11O6 299.0565 3.01 151.0397, 284.0327 So, Mm, Cr, Sh, Cp, Sd 69,32
97 Cirsimaritin 19.34 C17H13O6 313.0724 3.19 298.0488, 283.0249 Ss, Cr 70,35
98 Isolariciresinol 19.61 C20H23O6 359.1502 1.95 345.1346, 344.1582, 313.0714 Sc 55,31
99 Salvianolic acid F isomer 19.77 C7H13O6 313.0722 3.19 269.0459, 159.8597 Cp 41
100 Rosmadial 20.03 C20H23O5 343.1552 1.75 299.1652, 315.1598 Sc
101 Eupatorin 20.06 C18H15O7 343.0829 3.21 328.0595, 313.0359, 298.0125 Cb, Mm, Ss, Cr, Cp 48,50
102 Teucrol 20.3 C17H15O6 315.0880 3.5 179.0349, 135.0447, 161.0244 Ss 51
103 Dihydroxy-methoxyflavone 20.32 C16H11O5 283.0617 3.53 268.0386, 151.0034, 107.0327 Mm, Cp 29,30
104 Dihydroxy-dimethoxyflavanone 20.36 C16H13O5 285.0773 3.51 153.0190, 161.0453, 179.0349, 151.0397, 243.0668, 270.0535, 164.0012 Mm 29,30
105 Genkwanin 20.47 C16H11O5 283.0616 3.18 268.0386, 239.0922, 165.0192 Ss, Cr, Sh 43
106 Sakuranetin 20.57 C16H13O5 285.0771 2.81 241.1076, 165.0188, 121.0289 Cr 29
107 Octadecendioic acid 20.68 C18H31O4 311.2232 2.89 310.2107 So, Sh 23
108 Octadihydroxyoctadecadienoic acid 21.15 C18H31O4 311.2229 1.93 197.8076 Sc 23
109 Carnosol 22.2 C20H25O4 329.1761 2.7 285.1861 Ss, Sc 38,39,54
110 5-Epi-icetexone 22.45 C20H21O5 341.1396 0.88 297.1500, 299.1652 Sc 56
111 9,10-Dihydroxystearic acid 23.47 C18H35O4 315.2547 3.47 Ss 23

*Clinopodium brevicalyx (Cb), Salvia oppositiflora (So), Minthostachys mollis (Mm), Salvia sagittata (Ss), Salvia cuspidate (Sc), Clinopodium revolutum (Cr), Clinopodium sericeum (Cs), Salvia haenkei (Sh), Hedeoma mandoniana (Hm), Clinopodium pulchellum (Cp).