LMPK12010027 LIPID_MAPS_STRUCTURE_DATABASE 52 57 0 0 0 999 V2000 10.5202 11.4598 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5203 10.4717 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3760 9.9778 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2314 10.4718 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2314 11.4597 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3760 11.9537 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0871 9.9778 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9425 10.4718 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9426 11.4597 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0870 11.9538 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.7979 11.9537 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6698 11.4500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.5419 11.9537 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.5418 12.9606 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6698 13.4638 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7979 12.9606 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.4134 13.4636 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.6652 11.9537 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.3762 8.9904 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.9772 9.9278 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.3633 7.2643 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3616 7.2785 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3775 9.0162 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.8810 9.8679 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4050 10.5703 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.3777 8.9962 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8712 8.1332 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8679 8.1416 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3760 9.0104 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8825 9.8735 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3905 10.7424 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.5337 11.1033 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.3477 10.2572 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.5194 8.2677 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.8886 8.5352 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.0162 6.6148 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.7998 9.5345 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.6193 10.1084 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.5282 9.6832 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.6138 8.6885 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.7942 8.1145 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8800 7.1197 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1576 4.8070 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.1622 4.6467 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.0305 6.2920 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.4502 7.3586 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.0210 6.5335 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5916 5.6296 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5915 5.5506 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0257 6.3733 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4550 7.2771 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8891 8.0998 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 14 17 1 0 0 0 0 1 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 1 0 0 38 32 1 6 0 0 39 33 1 1 0 0 40 34 1 6 0 0 51 46 1 0 0 0 46 47 1 0 0 0 47 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 6 0 0 47 36 1 1 0 0 48 43 1 6 0 0 49 44 1 6 0 0 50 45 1 1 0 0 37 20 1 1 0 0 M CHG 1 10 1 M END > LMPK12010027 > > Pelargonidin 3-rutinoside-5-glucoside > C33H41O19 > 741.22 > Polyketides [PK] > Flavonoids [PK12] > Anthocyanidins [PK1201] > - > > C12645 > - > - > 31969 > - > - > - > - > FL7AAAGL0013 > 44256632 > - > - > Active > - > https://www.lipidmaps.org/data/LMSDRecord.php?LMID=LMPK12010027 $$$$