LMPK12010204 LIPID_MAPS_STRUCTURE_DATABASE 118128 0 0 0 999 V2000 13.8925 23.6751 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7617 24.1769 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7617 25.1804 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8925 25.6823 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0234 25.1804 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0234 24.1769 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6307 23.6751 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.4997 24.1769 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.4997 25.1804 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6307 25.6823 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.3275 25.6585 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.1584 25.1789 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.9892 25.6585 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.9892 26.6175 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.1584 27.0975 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.3275 26.6175 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.8521 27.1158 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.2706 25.6778 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.8925 22.7350 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.1224 23.5577 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0529 25.1928 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3158 24.6061 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6266 25.2263 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3158 23.6643 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1415 23.1877 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1415 22.2757 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2843 21.7809 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2843 20.7909 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1415 20.2958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9989 20.7909 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9989 21.7809 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1415 19.4133 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7326 20.2392 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.1438 20.1624 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3203 20.6378 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.1703 19.3695 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.0050 25.1160 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 21.5386 20.3106 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.3422 20.8346 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 21.5386 19.4692 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.7928 19.0385 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.7928 18.1060 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.9142 17.5986 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.9142 16.5842 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.7928 16.0768 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.6713 16.5842 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.6713 17.5986 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.3468 16.1944 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 20.7945 15.2101 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.6788 16.6256 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.6726 15.6965 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0144 15.0342 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1846 15.6785 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4269 14.9867 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5904 15.4697 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7538 14.9867 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7538 14.0208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5904 13.5378 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4269 14.0208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5904 12.8022 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.0146 13.5941 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.3424 18.9706 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3424 18.1042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.3703 19.5318 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.2564 23.6764 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.5158 22.6880 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.7947 23.7008 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.5369 25.6901 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.4030 25.1835 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3959 24.1829 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5228 23.6886 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6623 24.1951 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6694 25.1957 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8089 25.7022 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.2587 21.9101 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.3998 20.1020 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.4090 19.9445 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.6952 22.5733 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.0122 20.6262 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.6951 22.6551 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2633 21.8314 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8316 20.9257 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.8363 20.8471 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2681 21.6708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2727 21.5921 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.0000 25.2763 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 23.1364 23.6284 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 22.2774 21.8256 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 20.1439 23.3878 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 20.9887 20.9567 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 20.5730 24.2947 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.5704 24.3749 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.1390 23.5482 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.7094 22.6469 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.7120 22.5667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.2824 21.6653 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.6060 13.2176 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.7858 12.3846 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.1596 13.5436 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 19.0685 15.3734 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.5277 14.9636 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 19.8871 14.7934 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.7928 13.7972 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.8800 13.3808 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.0670 13.9604 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.1613 14.9565 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.3481 15.5361 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7173 12.0701 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7486 12.4317 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0812 14.3139 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.6945 14.7179 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3781 15.8396 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.0323 13.7732 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3837 13.0112 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3971 13.1937 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0635 14.1348 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7121 14.8968 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3785 15.8379 0.0000 C 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 2 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 3 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 14 17 1 0 0 0 0 5 18 1 0 0 0 0 1 19 1 0 0 0 0 8 20 1 0 0 0 0 21 22 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 28 33 1 0 0 0 0 34 35 2 0 0 0 0 34 36 1 0 0 0 0 13 37 1 0 0 0 0 38 39 2 0 0 0 0 38 40 1 0 0 0 0 40 41 2 0 0 0 0 41 42 1 0 0 0 0 42 43 2 0 0 0 0 43 44 1 0 0 0 0 44 45 2 0 0 0 0 45 46 1 0 0 0 0 46 47 2 0 0 0 0 47 42 1 0 0 0 0 46 48 1 0 0 0 0 45 49 1 0 0 0 0 50 51 2 0 0 0 0 51 52 1 0 0 0 0 52 53 2 0 0 0 0 53 54 1 0 0 0 0 54 55 2 0 0 0 0 55 56 1 0 0 0 0 56 57 2 0 0 0 0 57 58 1 0 0 0 0 58 59 2 0 0 0 0 59 54 1 0 0 0 0 58 60 1 0 0 0 0 57 61 1 0 0 0 0 36 62 1 0 0 0 0 62 63 1 0 0 0 0 62 64 2 0 0 0 0 73 68 1 0 0 0 68 69 1 0 0 0 69 70 1 0 0 0 70 71 1 0 0 0 71 72 1 0 0 0 72 73 1 0 0 0 73 74 1 1 0 0 69 18 1 1 0 0 70 65 1 6 0 0 71 66 1 1 0 0 72 67 1 6 0 0 21 74 1 0 0 0 79 85 1 0 0 0 84 78 1 0 0 0 78 80 1 0 0 0 80 81 1 0 0 0 81 82 1 0 0 0 82 83 1 0 0 0 83 84 1 0 0 0 84 85 1 1 0 0 80 20 1 1 0 0 81 75 1 6 0 0 82 76 1 1 0 0 83 77 1 6 0 0 79 34 1 0 0 0 0 90 96 1 0 0 0 95 89 1 0 0 0 89 91 1 0 0 0 91 92 1 0 0 0 92 93 1 0 0 0 93 94 1 0 0 0 94 95 1 0 0 0 95 96 1 1 0 0 91 37 1 1 0 0 92 86 1 6 0 0 93 87 1 1 0 0 94 88 1 6 0 0 90 38 1 0 0 0 0 101107 1 0 0 0 106100 1 0 0 0 100102 1 0 0 0 102103 1 0 0 0 103104 1 0 0 0 104105 1 0 0 0 105106 1 0 0 0 106107 1 1 0 0 102 49 1 1 0 0 103 97 1 6 0 0 104 98 1 1 0 0 105 99 1 6 0 0 51101 1 0 0 0 0 112118 1 0 0 0 117111 1 0 0 0 111113 1 0 0 0 113114 1 0 0 0 114115 1 0 0 0 115116 1 0 0 0 116117 1 0 0 0 117118 1 1 0 0 113 61 1 1 0 0 114108 1 6 0 0 115109 1 1 0 0 116110 1 6 0 0 M CHG 1 10 1 M END > LMPK12010204 > > Cyanidin 3-O-[6-O-(malonyl)-beta-D-glucopyranoside]-7-O-[6-O-(trans-caffeyl)-beta-D-glucopyranoside]-3'-O-[6-O-(trans-4-O-(6-O-(trans-4-O-(beta-D-glucopyranosyl)-caffeyl)-beta-D-glucopyranosyl)-caffeyl)-beta-D-glucopyranoside] > C75H81O43 > 1669.42 > Polyketides [PK] > Flavonoids [PK12] > Anthocyanidins [PK1201] > - > > - > - > - > - > - > - > - > - > FL7AACGL0095 > 44256809 > - > - > Active > - > https://lipidmaps.org/databases/lmsd/LMPK12010204 $$$$