LMPK12010014 LIPID_MAPS_STRUCTURE_DATABASE 46 50 0 0 0 999 V2000 8.1949 13.3100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1949 12.2693 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0961 11.7489 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9973 12.2693 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9973 13.3100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0961 13.8304 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8986 11.7489 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7999 12.2693 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7999 13.3100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8986 13.8304 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.7793 13.8756 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6808 13.3552 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5821 13.8756 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5821 14.9163 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6808 15.4365 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7793 14.9163 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.3896 15.3825 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.6124 11.8001 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4632 13.7323 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0718 11.0453 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5223 8.2907 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6210 8.8111 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5223 7.2499 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6210 6.7295 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7195 7.2499 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6210 5.6889 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.6930 10.1377 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.8469 8.3234 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.8572 8.1519 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.1248 10.7825 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.4557 8.8235 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.1242 10.8716 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6982 10.0518 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2728 9.1431 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2781 9.0573 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7041 9.8771 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7093 9.7913 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5128 10.9706 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.1443 9.8109 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.9537 7.8230 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.4145 8.5613 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.5076 9.5602 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.4174 9.9767 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.2345 9.3943 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.1390 8.4004 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2292 7.9840 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 8 18 1 0 0 0 0 1 19 1 0 0 0 0 3 20 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 31 37 1 0 0 0 36 30 1 0 0 0 30 32 1 0 0 0 32 33 1 0 0 0 33 34 1 0 0 0 34 35 1 0 0 0 35 36 1 0 0 0 36 37 1 1 0 0 33 27 1 6 0 0 34 28 1 1 0 0 35 29 1 1 0 0 46 41 1 0 0 0 41 42 1 0 0 0 42 43 1 0 0 0 43 44 1 0 0 0 44 45 1 0 0 0 45 46 1 0 0 0 42 27 1 1 0 0 43 38 1 6 0 0 44 39 1 1 0 0 45 40 1 6 0 0 32 18 1 1 0 0 31 21 1 0 0 0 0 M CHG 1 10 1 M END > LMPK12010014 > > Pelargonidin 3-O-[2-O-(beta-D-xylopyranosyl)-6-O-(malonyl)-beta-D-galactopyranoside] > C29H31O17 > 651.16 > Polyketides [PK] > Flavonoids [PK12] > Anthocyanidins [PK1201] > - > > - > - > - > - > - > - > - > - > FL7AAAGA0008 > 44256619 > - > - > Active > - > https://www.lipidmaps.org/data/LMSDRecord.php?LMID=LMPK12010014 $$$$