LMPK12010033 LIPID_MAPS_STRUCTURE_DATABASE 54 59 0 0 0 0 0 0 0 0999 V2000 6.2984 13.3026 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2984 12.4432 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0427 12.0134 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7871 12.4432 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7871 13.3026 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0427 13.7323 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5314 12.0134 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2757 12.4432 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2757 13.3026 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5314 13.7323 0.0000 O 0 3 0 0 0 0 0 0 0 0 0 0 10.0197 13.7322 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7782 13.2941 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5368 13.7322 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5368 14.6081 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7782 15.0461 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0197 14.6081 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5544 13.7322 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.2952 15.0459 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0427 11.1542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.9505 11.8359 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.5131 12.0682 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 11.1543 11.4465 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 11.8444 11.6438 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.5387 11.4465 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 12.8977 12.0682 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 12.2075 11.8709 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 10.8381 11.8874 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.5606 12.4827 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.6508 11.8664 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.0771 10.9081 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5320 10.0114 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.3860 9.3148 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5705 9.0963 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.7843 8.8663 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3735 8.0772 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8170 7.3090 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4200 6.6216 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8170 5.9340 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6108 5.9341 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0076 6.6215 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6107 7.3090 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0072 5.2474 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.8006 6.6216 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.7177 8.2092 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.7177 7.3319 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 16.3278 7.9625 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 17.1833 8.1780 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 17.1834 9.0555 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 16.5733 8.4250 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 17.7448 9.4487 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.6575 7.9043 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.3278 7.3173 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.5733 9.2168 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.0159 9.5386 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 21 22 1 0 0 0 0 22 23 1 1 0 0 0 23 24 1 1 0 0 0 25 24 1 1 0 0 0 25 26 1 0 0 0 0 26 21 1 0 0 0 0 21 27 1 0 0 0 0 26 28 1 0 0 0 0 25 29 1 0 0 0 0 22 20 1 0 0 0 0 24 30 1 0 0 0 0 30 31 1 0 0 0 0 31 32 1 0 0 0 0 32 33 2 0 0 0 0 32 34 1 0 0 0 0 34 35 2 0 0 0 0 35 36 1 0 0 0 0 36 37 2 0 0 0 0 37 38 1 0 0 0 0 38 39 2 0 0 0 0 39 40 1 0 0 0 0 40 41 2 0 0 0 0 41 36 1 0 0 0 0 39 42 1 0 0 0 0 40 43 1 0 0 0 0 45 44 1 1 0 0 0 45 46 1 0 0 0 0 46 47 1 0 0 0 0 47 48 1 0 0 0 0 48 49 1 1 0 0 0 49 44 1 1 0 0 0 48 50 1 0 0 0 0 47 51 1 0 0 0 0 46 52 1 0 0 0 0 43 45 1 0 0 0 0 49 53 1 0 0 0 0 53 54 1 0 0 0 0 M CHG 1 10 1 M END > LMPK12010033 > > Pelargonidin 3-[6-(3-glucosylcaffeyl) glucoside] > C36H37O18 > 757.20 > Polyketides [PK] > Flavonoids [PK12] > Anthocyanidins [PK1201] > - > > - > - > - > - > - > - > - > - > FL7AAAGL0019 > 44256638 > - > - > Active > - > https://www.lipidmaps.org/data/LMSDRecord.php?LMID=LMPK12010033 $$$$