LMGP02030061 LIPID_MAPS_STRUCTURE_DATABASE 55 54 0 0 0 999 V2000 26.4510 9.2882 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 25.5795 9.7900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 24.7076 9.2882 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 26.9549 8.4167 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 25.9471 8.4167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 27.3228 9.7916 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 28.1945 9.2882 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 30.3527 9.2673 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 31.2242 8.7640 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 32.0962 9.2673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 32.9679 8.7640 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 29.4349 9.6409 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 28.9909 8.8713 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 29.4349 10.5588 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 25.0341 7.9015 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 25.0341 6.8936 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 24.1625 8.4051 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.2847 7.9015 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.4063 8.4051 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.5277 7.9015 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.6492 8.4051 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.7708 7.9015 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.8923 7.9015 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.0138 8.4051 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.1354 7.9015 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.2568 7.9015 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.3783 8.4051 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4999 7.9015 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6214 7.9015 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7429 8.4051 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8645 7.9015 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9859 7.9015 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1075 8.4051 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2290 7.9015 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3505 8.4051 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4721 7.9015 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5936 8.4051 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.8289 9.7900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.9504 9.7900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.0718 9.2882 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.1934 9.7900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.3149 9.2882 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.4364 9.7900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.5580 9.2882 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.6795 9.7900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8011 9.2882 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.9225 9.7900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0440 9.2882 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1656 9.7900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2871 9.2882 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4086 9.7900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5302 9.2882 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6516 9.7900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7731 9.2882 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8947 9.7900 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 8 1 0 0 0 0 12 13 1 0 0 0 0 12 14 2 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 15 5 1 0 0 0 0 12 7 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 19 20 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 1 0 0 0 0 35 36 1 0 0 0 0 36 37 1 0 0 0 0 3 38 1 0 0 0 0 38 39 2 0 0 0 0 39 40 1 0 0 0 0 40 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 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 M END > LMGP02030061 > PE P-18:0/22:4(7Z,10Z,13Z,16Z) > 1-(1Z-octadecenyl)-2-(7Z,10Z,13Z,16Z-docosatetraenoyl)-glycero-3-phosphoethanolamine > C45H82NO7P > 779.58 > Glycerophospholipids [GP] > Glycerophosphoethanolamines [GP02] > 1-(1Z-alkenyl),2-acylglycerophosphoethanolamines [GP0203] > - > PE(P-40:4); PE(P-18:0/22:4) > TVTRPEJBOGUHBJ-IKHSQHJKSA-N > InChI=1S/C45H82NO7P/c1-3-5-7-9-11-13-15-17-19-21-22-23-24-26-28-30-32-34-36-38-45(47)53-44(43-52-54(48,49)51-41-39-46)42-50-40-37-35-33-31-29-27-25-20-18-16-14-12-10-8-6-4-2/h11,13,17,19,22-23,26,28,37,40,44H,3-10,12,14-16,18,20-21,24-25,27,29-36,38-39,41-43,46H2,1-2H3,(H,48,49)/b13-11-,19-17-,23-22-,28-26-,40-37-/t44-/m1/s1 > [C@](COP(=O)(O)OCCN)([H])(OC(CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCCC)=O)CO/C=C\CCCCCCCCCCCCCCCC > - > HMDB0011391 > 190172 > PE O-40:5 > 37136 > SLM:000050531 > 52925094 > - > - > - > - > - > 9913 > 38861160 $$$$