LMGP01030014 LIPID_MAPS_STRUCTURE_DATABASE 58 57 0 0 0 999 V2000 26.7869 9.5466 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 25.9115 10.0505 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 25.0359 9.5466 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 27.2929 8.6713 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 26.2808 8.6713 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 27.6625 10.0520 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 28.5381 9.5466 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 30.7055 9.5256 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 31.5809 9.0199 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 32.4565 9.5256 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 33.3321 9.0199 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 34.2078 9.5256 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 33.3321 8.0090 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 34.2078 8.5146 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 29.7838 9.9008 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 29.3377 9.1277 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 29.7838 10.8227 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 25.3639 8.1539 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 25.3639 7.1415 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 24.4884 8.6595 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.6067 8.1539 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.7241 8.6595 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.8418 8.6595 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.9594 8.1539 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.0771 8.6595 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.1947 8.6595 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.3124 8.1539 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.4300 8.6595 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.5476 8.6595 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6653 8.1539 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7828 8.6595 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9007 8.6595 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0183 8.1539 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1358 8.6595 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2534 8.6595 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3711 8.1539 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4887 8.6595 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6064 8.6595 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7239 8.1539 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8416 8.6595 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 24.1532 10.0505 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.2709 10.0505 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.3885 9.5466 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.5060 10.0505 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.6238 9.5466 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.7413 10.0505 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.8590 9.5466 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.9765 10.0505 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.0942 9.5466 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.2118 10.0505 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.3295 9.5466 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4471 10.0505 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5648 9.5466 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6823 10.0505 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7999 9.5466 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9176 10.0505 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0352 9.5466 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1529 10.0505 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 1 5 1 6 0 0 0 1 4 1 1 0 0 0 6 1 1 0 0 0 0 7 6 1 0 0 0 0 9 8 1 0 0 0 0 10 9 1 0 0 0 0 11 10 1 0 0 0 0 12 11 1 0 0 0 0 11 13 1 0 0 0 0 11 14 1 0 0 0 0 15 8 1 0 0 0 0 15 16 1 0 0 0 0 15 17 2 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 18 5 1 0 0 0 0 15 7 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 22 23 2 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 25 26 2 0 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 28 29 2 0 0 0 0 29 30 1 0 0 0 0 30 31 1 0 0 0 0 31 32 2 0 0 0 0 32 33 1 0 0 0 0 33 34 1 0 0 0 0 34 35 2 0 0 0 0 35 36 1 0 0 0 0 36 37 1 0 0 0 0 37 38 2 0 0 0 0 38 39 1 0 0 0 0 39 40 1 0 0 0 0 3 41 1 0 0 0 0 41 42 2 0 0 0 0 42 43 1 0 0 0 0 43 44 1 0 0 0 0 44 45 1 0 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 0 0 0 0 49 50 1 0 0 0 0 50 51 1 0 0 0 0 51 52 1 0 0 0 0 52 53 1 0 0 0 0 53 54 1 0 0 0 0 54 55 1 0 0 0 0 55 56 1 0 0 0 0 56 57 1 0 0 0 0 57 58 1 0 0 0 0 M CHG 2 11 1 16 -1 M END > LMGP01030014 > PC P-18:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z) > 1-(1Z-octadecenyl)-2-(4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl)-sn-glycero-3-phosphocholine > C48H84NO7P > 817.60 > Glycerophospholipids [GP] > Glycerophosphocholines [GP01] > 1-(1Z-alkenyl),2-acylglycerophosphocholines [GP0103] > - > PC(P-18:0/22:6); PC(P-40:6); PC(P-18:0/22:6) > TXHZYNSTTCIWMJ-RXSQUPBGSA-N > InChI=1S/C48H84NO7P/c1-6-8-10-12-14-16-18-20-22-24-25-26-27-29-31-33-35-37-39-41-48(50)56-47(46-55-57(51,52)54-44-42-49(3,4)5)45-53-43-40-38-36-34-32-30-28-23-21-19-17-15-13-11-9-7-2/h8,10,14,16,20,22,25-26,29,31,35,37,40,43,47H,6-7,9,11-13,15,17-19,21,23-24,27-28,30,32-34,36,38-39,41-42,44-46H2,1-5H3/b10-8-,16-14-,22-20-,26-25-,31-29-,37-35-,43-40-/t47-/m1/s1 > [C@](COP(=O)([O-])OCC[N+](C)(C)C)([H])(OC(CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CC)=O)CO/C=C\CCCCCCCCCCCCCCCC > - > HMDB0011262 > 133664 > PC O-40:7 > 37134 > SLM:000049042 > 42607430 > - > - > - > - > - > 9606 > 21035124 $$$$