LMGP01020354 LIPID_MAPS_STRUCTURE_DATABASE 58 57 0 0 0 0 0 0 0 0999 V2000 -2.5551 0.5631 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4284 1.0659 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3020 0.5631 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0503 -0.3102 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0599 -0.3102 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6816 1.0675 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8081 0.5631 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3542 0.5422 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2276 0.0378 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1011 0.5422 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9746 0.0378 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8481 0.5422 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9746 -0.9709 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8481 -0.4664 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4346 0.9165 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 -0.0103 0.1452 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4346 1.8362 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9748 -0.8264 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9748 -1.8362 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8481 -0.3218 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7278 -0.8264 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6080 -0.3218 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4883 -0.8264 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3686 -0.3218 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2489 -0.8264 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.1291 -0.8264 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.0094 -0.3218 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.8897 -0.8264 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.7700 -0.8264 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.6502 -0.3218 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.5305 -0.8264 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.4108 -0.8264 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.2911 -0.3218 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -17.1713 -0.8264 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -18.0516 -0.8264 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -18.9319 -0.3218 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -19.8122 -0.8264 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -20.6924 -0.8264 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -21.5727 -0.3218 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -22.4530 -0.8264 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1825 1.0659 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0628 0.5631 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9430 1.0659 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8233 0.5631 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7036 1.0659 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5839 0.5631 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.4641 1.0659 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.3444 0.5631 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.2247 1.0659 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.1050 1.0659 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.9852 0.5631 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.8655 1.0659 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.7458 0.5631 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.6261 1.0659 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -17.5063 0.5631 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -18.3866 1.0659 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -19.2669 0.5631 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -20.1471 1.0659 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 1 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 1 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 2 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 > LMGP01020354 > PC O-18:1(9Z)/22:5(7Z,10Z,13Z,16Z,19Z) > 1-(9Z-octadecenyl)-2-(7Z,10Z,13Z,16Z,19Z-docosapentaenoyl)-sn-glycero-3-phosphocholine > C48H86NO7P > 819.61 > Glycerophospholipids [GP] > Glycerophosphocholines [GP01] > 1-alkyl,2-acylglycerophosphocholines [GP0102] > - > > ZCAILPAGIIBRNC-VSHIVGQZSA-N > InChI=1S/C48H86NO7P/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/h8,10,14,16,20-23,25-26,29,31,47H,6-7,9,11-13,15,17-19,24,27-28,30,32-46H2,1-5H3/b10-8-,16-14-,22-20-,23-21-,26-25-,31-29-/t47-/m1/s1 > [C@](COP(=O)([O-])OCC[N+](C)(C)C)([H])(OC(CCCCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CC)=O)COCCCCCCCC/C=C\CCCCCCCC > - > - > - > PC O-40:6 > - > SLM:000027830 > - > - > - > - > - > - > 10090 > 40790030 $$$$