LMPK12010060 LIPID_MAPS_STRUCTURE_DATABASE 83 90 0 0 0 999 V2000 4.7140 0.2692 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7140 -0.7414 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5891 -1.2466 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4644 -0.7414 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4644 0.2692 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5891 0.7746 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3395 -1.2466 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2148 -0.7414 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2148 0.2692 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3395 0.7746 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0898 0.7743 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9817 0.2592 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8737 0.7743 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8737 1.8045 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9817 2.3193 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0898 1.8045 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8391 0.7743 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.7655 2.3191 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5909 -2.1827 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.1555 -1.3431 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4140 -4.0530 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7052 -4.8352 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1786 -3.7471 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9706 -2.0294 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5855 -2.4142 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7390 -2.5739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6506 -3.5091 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7937 -3.9000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0304 -3.3559 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1190 -2.4208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3556 -1.8767 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9792 -3.2141 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.5186 -4.2918 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.2164 -3.4975 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.7643 -1.4842 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.0408 -2.2935 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.9101 -1.8810 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8283 -2.8168 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6004 -3.3561 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4494 -2.9589 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5312 -2.0230 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3804 -1.6259 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1699 -2.4015 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2757 -3.5115 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.9891 -1.7140 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.9442 -2.0617 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.9724 -1.1987 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.9421 -1.5516 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.7327 -0.8882 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.5535 0.1278 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.5839 0.4808 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.7933 -0.1826 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.3423 0.7897 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.2747 -5.0701 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8353 -6.2780 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0745 -5.6347 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3458 -3.5026 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2312 -3.8235 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3944 -4.7485 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6720 -5.3530 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7918 -5.0313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6287 -4.1061 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6959 -1.9975 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1096 -2.5597 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9990 -2.1433 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6119 -1.0190 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8046 -2.7053 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0831 -1.1646 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.4124 1.4538 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.1694 2.0888 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1001 -5.8811 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4677 -6.7993 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.1697 -5.8810 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6777 -6.7613 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0203 -6.7612 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5361 -7.6547 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5681 -7.6547 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0839 -6.7613 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5682 -5.8677 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5361 -5.8676 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.1136 -6.7612 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.0623 -5.0121 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.0504 -5.0121 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 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 25 31 1 0 0 0 30 24 1 0 0 0 24 26 1 0 0 0 26 27 1 0 0 0 27 28 1 0 0 0 28 29 1 0 0 0 29 30 1 0 0 0 30 31 1 1 0 0 26 19 1 1 0 0 27 21 1 6 0 0 28 22 1 1 0 0 29 23 1 6 0 0 36 42 1 0 0 0 41 35 1 0 0 0 35 37 1 0 0 0 37 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 6 0 0 38 32 1 1 0 0 39 33 1 6 0 0 40 34 1 1 0 0 43 44 2 0 0 0 0 43 45 1 0 0 0 0 45 46 2 0 0 0 0 46 47 1 0 0 0 0 47 48 2 0 0 0 0 48 49 1 0 0 0 0 49 50 2 0 0 0 0 50 51 1 0 0 0 0 51 52 2 0 0 0 0 52 47 1 0 0 0 0 50 53 1 0 0 0 0 36 43 1 0 0 0 0 62 57 1 0 0 0 57 58 1 0 0 0 58 59 1 0 0 0 59 60 1 0 0 0 60 61 1 0 0 0 61 62 1 0 0 0 59 54 1 6 0 0 60 55 1 1 0 0 61 56 1 6 0 0 58 32 1 1 0 0 37 20 1 6 0 0 25 63 1 0 0 0 63 64 1 0 0 0 64 65 1 0 0 0 63 66 2 0 0 0 65 67 2 0 0 0 65 68 1 0 0 0 51 69 1 0 0 0 69 70 1 0 0 0 71 72 2 0 0 0 71 73 1 0 0 0 73 74 2 0 0 0 74 75 1 0 0 0 75 76 2 0 0 0 76 77 1 0 0 0 77 78 2 0 0 0 78 79 1 0 0 0 79 80 2 0 0 0 80 75 1 0 0 0 78 81 1 0 0 0 79 82 1 0 0 0 82 83 1 0 0 0 54 71 1 0 0 0 M CHG 1 10 1 M END > LMPK12010060 > > Pelargonidin 3-(6'',2'''-diferulylsambubioside)-5-(6-malonylglucoside) > C55H57O28 > 1165.30 > Polyketides [PK] > Flavonoids [PK12] > Anthocyanidins [PK1201] > - > > - > - > - > - > - > - > - > - > FL7AAAGL0046 > 44256665 > - > - > Active > - > https://dev.lipidmaps.org/databases/lmsd/LMPK12010060 $$$$