LMPK12010176 LIPID_MAPS_STRUCTURE_DATABASE 66 72 0 0 0 999 V2000 10.8497 -6.3327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8497 -7.3532 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7335 -7.8635 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6172 -7.3532 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6172 -6.3327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7335 -5.8224 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5011 -7.8635 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3848 -7.3532 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3848 -6.3327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5011 -5.8224 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.2684 -5.8228 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.1690 -6.3427 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.0697 -5.8228 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.0697 -4.7826 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.1690 -4.2624 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2684 -4.7826 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9662 -5.8228 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.9703 -4.2626 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.7335 -8.8836 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.1717 -8.1322 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.1690 -3.2227 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 20.1839 -8.4147 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.1379 -8.9655 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 20.1839 -7.3984 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.8700 -7.0022 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.8700 -5.9223 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.7614 -5.4077 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.7614 -4.3785 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.8700 -3.8640 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.9787 -4.3785 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.9787 -5.4077 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.8700 -2.8349 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.7191 -10.9071 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.9593 -11.9065 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2192 -10.8824 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.9807 -8.8712 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4576 -9.5078 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.8562 -9.3833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8490 -10.3951 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9663 -10.8947 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0964 -10.3827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1036 -9.3711 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2336 -8.8589 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.3264 -8.8642 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.0848 -10.0663 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.7322 -11.0172 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.3743 -10.0664 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.7324 -8.1644 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.9058 -8.6399 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.9059 -9.5907 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.7323 -10.0664 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.5532 -9.5908 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.5533 -8.6400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.3744 -8.1646 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2513 -10.5715 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.7721 -12.4122 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.1251 -13.7428 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.5224 -11.6544 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.5582 -14.0999 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.8445 -10.9842 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9277 -11.2368 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6889 -12.1597 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3654 -12.8249 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2821 -12.5723 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.9586 -13.2376 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.6369 -3.8730 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 2 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 5 6 1 0 0 0 0 6 1 2 0 0 0 0 4 7 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 5 1 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 16 11 1 0 0 0 0 1 17 1 0 0 0 0 14 18 1 0 0 0 0 3 19 1 0 0 0 0 20 8 1 0 0 0 0 15 21 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 25 2 0 0 0 0 25 26 1 0 0 0 0 26 27 2 0 0 0 0 27 28 1 0 0 0 0 28 29 2 0 0 0 0 29 30 1 0 0 0 0 30 31 2 0 0 0 0 31 26 1 0 0 0 0 29 32 1 0 0 0 0 37 43 1 0 0 0 42 36 1 0 0 0 36 38 1 0 0 0 38 39 1 0 0 0 39 40 1 0 0 0 40 41 1 0 0 0 41 42 1 0 0 0 42 43 1 1 0 0 38 19 1 1 0 0 39 33 1 6 0 0 40 34 1 1 0 0 41 35 1 6 0 0 53 48 1 0 0 0 48 49 1 0 0 0 49 50 1 0 0 0 50 51 1 0 0 0 51 52 1 0 0 0 52 53 1 0 0 0 53 54 1 6 0 0 50 45 1 1 0 0 51 46 1 6 0 0 52 47 1 1 0 0 59 65 1 0 0 0 64 58 1 0 0 0 58 60 1 0 0 0 60 61 1 0 0 0 61 62 1 0 0 0 62 63 1 0 0 0 63 64 1 0 0 0 64 65 1 6 0 0 60 45 1 6 0 0 61 55 1 1 0 0 62 56 1 6 0 0 63 57 1 1 0 0 44 54 1 0 0 0 49 20 1 6 0 0 22 44 1 0 0 0 0 28 66 1 0 0 0 M CHG 1 10 1 M END > LMPK12010176 > > Cyanidin 3-(6''-caffeylsophoroside)-5-glucoside > C42H47O24 > 935.25 > Polyketides [PK] > Flavonoids [PK12] > Anthocyanidins [PK1201] > - > > - > - > - > - > - > - > - > - > FL7AACGL0067 > 100930187 > - > - > Active > - > https://lipidmaps.org/index.php/databases/lmsd/LMPK12010176 $$$$