Table 6. Summary of Chemical Constituents Identified in the Standardized Botanical Supplement by LC–MS/MS.
|
m/z observed |
|||||||||
|---|---|---|---|---|---|---|---|---|---|
| sr.no. | retention time (Rt) | Rf | (λmax)a | peak number | MFb | MWc | +ve mode | –ve mode | references |
| 1 | 2.943 | 208 | AP1 | unknown | 349, 367 | 345, 355 | |||
| 2 | 3.115 | 212 | AP2 | unknown | 348, 370 | ||||
| 3 | 3.640 | 225, 262 | AP3 | C16H24O8 | 344 | 345, 367 | (30) | ||
| 4 | 3.866 | 231, 286 | AP4 | C16H28O8 | 348 | 371, 387 | 391 | (30) | |
| 5 | 3.982 | FL5 | kaempferol-3.7.4′-triglucoside | 773 | 773, 795 | 771, 817 | (30, 35, 36) | ||
| 6 | 4.121 | 238 | AP6 | C20H30O13 | 478 | 501 | 523 | (30) | |
| 7 | 4.367 | 241 | AP7 | C20H30O13 | 478 | 501 | (30) | ||
| 8 | 4.648 | 245 | AP8 | unknown | 434 | 435, 467 | |||
| 9 | 4.821 | 245 | AP9 | C20H30O13 | 332 | 355, 371 | 377 | ||
| 10 | 5.013 | 242 | AP10 | (C16H26O8) | 346 | 369, 385, 410 | 391, 417 | (30) | |
| 11 | 5.400 | 249 | AP11-12 | C14H20O8 | 316 | 355, 317, 339 | 361, 429 | (30) | |
| 12 | 5.596 | 248 | AP13 | C22H36O12 | 492 | 515 | 537 | (30) | |
| 13 | 6.019 | 248 | AP14 | unknown | 360 | 383 | 473 | ||
| 14 | 6.680 | 247 | AP15 | unknown | 330 | 353, | 376, 365, 443 | ||
| 15 | 6.901 | 254 | AP16 | unknown | 343 | 366, 406 | 387 | ||
| 16 | 7.172 | 0.63 | 250 | AP17 | picrocrocin | 330 | 353, 369, 399 | 376, 365, 443 | (30, 36) |
| 17 | 7.563 | 244, 262 | CR18 | unknown | 453 | 454, 476 | 565, 497, 566 | ||
| 18 | 7.856 | 0.53 | 442 | FL19 | kaempferol-3-sophoroside | 610 | 611, 633 | 609, 610, 655 | (30, 38, 39) |
| 19 | 8.119 | 439 | CR20 | trans-5-tG-crocin | 1138 | 329, 635, 1161 | 1183 | (35, 38) | |
| 20 | 8.273 | 418, 436 | CR21 | trans-5-nG-crocin | 1138 | 329, 635, 1161 | 1183 | (28, 30) | |
| 21 | 8.530 | 0.16 | 440, 463 | CR22 | trans-4-GG-crocin | 976 | 329, 681, 999, | 723, 533, 1021 | (28−30, 36, 37, 40) |
| 22 | 8.725 | 439, 462 | CR23 | unknown | 794, 816 | ||||
| 23 | 8.925 | 0.33 | 437 | CR24 | trans-3-Gg-crocin | 814 | 837, 832, 814, 815 | 859, 860, 849 | (28−30, 36, 40) |
| 24 | 9.28 | 440, 463 | CR25 | cis-5-tG-crocin | 1138 | 1138 | (48) | ||
| 25 | 9.446 | 436 | CR26 | trans-2-G-crocin | 652 | 329, 547, 675, 837 | 697, 765, 249 | (28, 30, 37, 39, 40) | |
| 26 | 9.516 | 434 | CR27 | cis-5-nG-crocin | 1138 | 329, 625, 837, 1139 | (30, 43) | ||
| 27 | 9.786 | 431 | CR28 | cis-4-GG-crocin | 976 | 329, 508, 697, 735, 999 | 651, 975, 1089 | (30, 37, 40, 43) | |
| 28 | 10.259 | 434, 457 | CR29 | trans-2-gg-crocin | 652 | 329, 651, 675, 691 | 697, 651, 698 | (30, 38−40) | |
| 29 | 10.279 | 433, 456 | CR30 | cis-3-Gg-crocin | 814 | 329, 837, 675 | 697, 765, 859 | (28, 30, 33, 37) | |
| 30 | 10.880 | 252, 427 | CR31 | cis-2G-crocin | 652 | 329, 541, 675 | 563, 631, 517 | (30, 37, 40) | |
| 31 | 11.122 | 251, 426 | CR32 | trans-1-g-crocin | 490 | 554, 329, 513 | 535, 525, 681 | (28, 30, 40) | |
| 32 | 11.370 | 255, 432 | CR33 | cis-2-gg-crocin | 652 | 274, 329, 675 | (28, 30, 39) | ||
| 33 | 11.984 | FL34 | dihydro kaempferol | 288 | 288, 330 | 286, 354 | |||
| 34 | 13.486 | 425, 450 | CR35 | trans-crocetin | 328 | 329, 594 | (28, 30, 36, 43) | ||
| 35 | 14.146 | 265 | AP36 | safranal | 150 | 151, 192 | (28, 30, 36, 39) | ||
Wavelength.
Molecular formula.
Molecular weight.