LMGP20020025 LIPID_MAPS_STRUCTURE_DATABASE 47 46 0 0 0 999 V2000 4.5581 0.5548 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7008 1.0484 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8434 0.5548 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9863 1.0484 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9863 2.0393 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2937 -0.5425 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8226 -0.5425 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1290 0.5548 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4157 1.0498 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2731 0.5548 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3955 0.5341 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.2529 0.0391 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1104 0.5341 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9678 0.0391 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.4929 0.9017 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 7.0562 0.1446 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4929 1.8044 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9246 -1.0492 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9246 -1.9205 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0673 -0.5538 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2028 -1.0492 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3386 -0.5539 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5255 -1.0492 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3896 -0.5539 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2537 -1.0492 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1177 -0.5539 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9819 -1.0492 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8459 -0.5539 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7101 -1.0492 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5741 -0.5539 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9819 -2.0393 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.4383 -1.0492 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.5741 0.1061 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2654 1.0498 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5987 0.5548 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4628 1.0498 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3269 0.5548 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1910 1.0498 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0550 0.5548 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9192 1.0498 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7832 0.5548 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6474 1.0498 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5114 0.5548 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3755 1.0498 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2396 0.5548 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.1037 1.0498 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.9678 0.5548 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 2 3 1 0 0 0 3 4 1 0 0 0 4 5 2 0 0 0 4 8 1 0 0 0 1 7 1 6 0 0 1 6 1 1 0 0 9 1 1 0 0 0 10 9 1 0 0 0 12 11 1 0 0 0 13 12 1 0 0 0 14 13 1 0 0 0 15 11 1 0 0 0 15 16 1 0 0 0 15 17 2 0 0 0 18 19 2 0 0 0 18 20 1 0 0 0 18 7 1 0 0 0 15 10 1 0 0 0 20 21 1 0 0 0 21 22 1 0 0 0 22 23 1 0 0 0 23 24 1 0 0 0 24 25 1 0 0 0 25 26 1 0 0 0 26 27 1 0 0 0 27 28 1 0 0 0 28 29 2 0 0 0 29 30 1 0 0 0 27 31 1 0 0 0 30 32 1 0 0 0 30 33 2 0 0 0 8 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 0 0 0 38 39 1 0 0 0 39 40 1 0 0 0 40 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 46 47 1 0 0 0 M END > LMGP20020025 > PHDdiA-PE > 1-hexadecanoyl-2-(9-hydroxy-11-carboxy-10E-undecenoyl)-sn-glycero-3-phosphoethanolamine > C33H62NO11P > 679.41 > Glycerophospholipids [GP] > Oxidized glycerophospholipids [GP20] > Oxidized glycerophosphoethanolamines [GP2002] > - > 1-palmitoyl-2-(9-hydroxy-11-carboxy-10E-undecenoyl)-sn-glycero-3-phosphoethanolamine > REEUASONVFSMBC-VBGIYYPRSA-N > InChI=1S/C33H62NO11P/c1-2-3-4-5-6-7-8-9-10-11-12-15-18-21-32(38)42-27-30(28-44-46(40,41)43-26-25-34)45-33(39)22-19-16-13-14-17-20-29(35)23-24-31(36)37/h23-24,29-30,35H,2-22,25-28,34H2,1H3,(H,36,37)(H,40,41)/b24-23+/t29?,30-/m1/s1 > [C@](COP(=O)(O)OCCN)([H])(OC(CCCCCCCC(O)/C=C/C(=O)O)=O)COC(CCCCCCCCCCCCCCC)=O > - > - > 187329 > PE 28:2;O3 > - > - > 134812356 > - > Glycerophospholipids [GP] > Glycerophosphoethanolamines [GP02] > Diacylglycerophosphoethanolamines [GP0201] > - > 10090 > 18285328 $$$$