LMPK12010404 LIPID_MAPS_STRUCTURE_DATABASE 89 97 0 0 0 999 V2000 6.2059 18.4483 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6821 19.3042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6096 19.3042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2579 18.4605 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2100 18.4605 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7298 19.2925 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7693 19.2925 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2891 18.4605 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7693 17.6288 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7298 17.6288 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4404 18.4605 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4661 22.0060 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0426 22.9136 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4640 22.3247 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0254 21.4327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1376 21.6845 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4764 22.6152 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4516 22.7871 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0882 22.0285 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7495 21.0978 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7741 20.9259 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8186 22.1574 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0744 27.6764 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9637 28.1897 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9637 29.2167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0744 29.7300 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1850 29.2167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1850 28.1897 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8529 27.6764 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7424 28.1897 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7424 29.2167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8529 29.7300 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5897 29.7059 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4398 29.2150 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2899 29.7059 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2899 30.6876 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4398 31.1784 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5897 30.6876 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1729 31.1974 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4574 29.6368 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0744 27.0031 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.7279 27.6513 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.4614 31.9791 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.1602 32.6779 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2162 29.2870 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.0482 29.7671 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2682 25.2243 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.7391 27.2820 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.4248 25.3554 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.1003 23.8035 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4080 25.9093 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5988 23.2867 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0713 26.6907 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0767 26.5061 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4193 25.5399 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7570 24.7641 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7516 24.9488 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0892 24.1728 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4498 21.4275 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2649 19.7606 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2339 19.9554 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9883 22.5497 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0089 22.4545 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4343 21.5250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8392 20.6902 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8240 20.7878 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3984 21.7172 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3830 21.8148 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5895 25.0243 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1332 23.5886 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1669 24.1330 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3602 26.5568 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3488 26.2859 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6063 25.2967 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8754 24.5780 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8924 24.8501 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6348 25.8396 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6517 26.1119 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0156 17.0249 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9872 17.5683 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4989 19.5434 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8032 19.7218 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0608 21.0697 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5435 18.7302 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2714 18.0125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2593 18.2861 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5149 19.2736 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7870 19.9913 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0428 20.9790 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 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 8 11 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 19 20 1 0 0 0 0 20 21 2 0 0 0 0 21 16 1 0 0 0 0 19 22 1 0 0 0 0 23 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 23 2 0 0 0 0 24 29 1 0 0 0 0 29 30 2 0 0 0 0 30 31 1 0 0 0 0 31 32 2 0 0 0 0 32 25 1 0 0 0 0 31 33 1 0 0 0 0 33 34 2 0 0 0 0 34 35 1 0 0 0 0 35 36 2 0 0 0 0 36 37 1 0 0 0 0 37 38 2 0 0 0 0 38 33 1 0 0 0 0 36 39 1 0 0 0 0 27 40 1 0 0 0 0 23 41 1 0 0 0 0 30 42 1 0 0 0 0 37 43 1 0 0 0 0 43 44 1 0 0 0 0 35 45 1 0 0 0 0 45 46 1 0 0 0 0 52 58 1 0 0 0 57 51 1 0 0 0 51 53 1 0 0 0 53 54 1 0 0 0 54 55 1 0 0 0 55 56 1 0 0 0 56 57 1 0 0 0 57 58 1 1 0 0 53 42 1 1 0 0 54 48 1 6 0 0 55 49 1 1 0 0 56 50 1 6 0 0 67 62 1 0 0 0 62 63 1 0 0 0 63 64 1 0 0 0 64 65 1 0 0 0 65 66 1 0 0 0 66 67 1 0 0 0 67 68 1 6 0 0 63 52 1 1 0 0 64 59 1 6 0 0 65 60 1 6 0 0 66 61 1 1 0 0 77 72 1 0 0 0 72 73 1 0 0 0 73 74 1 0 0 0 74 75 1 0 0 0 75 76 1 0 0 0 76 77 1 0 0 0 77 78 1 1 0 0 73 41 1 1 0 0 74 69 1 6 0 0 75 70 1 1 0 0 76 71 1 6 0 0 47 78 1 0 0 0 2 61 1 0 0 0 0 83 89 1 0 0 0 88 82 1 0 0 0 82 84 1 0 0 0 84 85 1 0 0 0 85 86 1 0 0 0 86 87 1 0 0 0 87 88 1 0 0 0 88 89 1 1 0 0 84 11 1 1 0 0 85 79 1 6 0 0 86 80 1 1 0 0 87 81 1 6 0 0 83 12 1 0 0 0 0 M CHG 1 32 1 M END > LMPK12010404 > > Malvidin 3-O-(6-O-(4-O-(4-O-(6-O-E-p-coumaroyl-beta-D-glucopyranosyl)-E-p-coumaroyl)-alpha-rhamnosyl)-beta-D-glucopyranoside)-5-O-beta-D-glucopyranoside > C59H67O30 > 1255.37 > Polyketides [PK] > Flavonoids [PK12] > Anthocyanidins [PK1201] > - > > - > - > - > - > - > - > - > - > FL7AAIGL0033 > 44257009 > - > - > Active > - > https://lipidmaps.org/databases/lmsd/LMPK12010404 $$$$