LMPK12010013 LIPID_MAPS_STRUCTURE_DATABASE 47 51 0 0 0 999 V2000 8.5600 12.8240 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5600 11.8068 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4409 11.2981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3219 11.8068 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3219 12.8240 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4409 13.3327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2029 11.2981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0839 11.8068 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0839 12.8240 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2029 13.3327 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.0414 13.3768 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9224 12.8682 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.8034 13.3768 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.8034 14.3941 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9224 14.9027 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0414 14.3941 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5929 14.8500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.8781 11.3481 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8447 13.2368 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.4409 10.3576 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9078 8.0484 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0267 8.5570 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9078 7.0311 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0267 6.5224 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1455 7.0311 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0267 5.5051 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1455 4.9964 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9943 9.7783 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.1481 7.9637 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.1581 7.7922 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.4257 10.4232 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.7564 8.4639 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.4253 10.5123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9994 9.6924 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5739 8.7836 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5791 8.6978 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0050 9.5177 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0100 9.4319 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.8144 10.6113 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.4461 9.4515 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.2555 7.4633 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.7159 8.2017 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.8090 9.2007 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7190 9.6173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.5362 9.0348 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.4407 8.0408 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5307 7.6243 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 26 27 1 0 0 0 0 32 38 1 0 0 0 37 31 1 0 0 0 31 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 0 0 0 37 38 1 1 0 0 34 28 1 6 0 0 35 29 1 1 0 0 36 30 1 1 0 0 47 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 46 47 1 0 0 0 43 28 1 1 0 0 44 39 1 6 0 0 45 40 1 1 0 0 46 41 1 6 0 0 33 18 1 1 0 0 32 21 1 0 0 0 0 M CHG 1 10 1 M END > LMPK12010013 > Pelargonidin 3-O-[2-O-(beta-D-xylopyranosyl)-6-O-(methyl-malonyl)-beta-D-galactopyranoside] > 3,5,7,4'-Tetrahydroxyflavylium 3-O-[2-O-(beta-D-xylopyranosyl)-6-O-(methyl-malonyl)-beta-D-galactopyranoside] > C30H33O17 > 665.17 > Polyketides [PK] > Flavonoids [PK12] > Anthocyanidins [PK1201] > - > > - > - > - > - > - > - > - > - > FL7AAAGA0007 > 101114165 > - > - > Active > - > https://www.lipidmaps.org/databases/lmsd/LMPK12010013 $$$$