Ketcher 06191514532D 1 1.00000 0.00000 0 54 53 0 1 0 999 V2000 18.0858 -3.9296 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2193 -3.4306 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.3531 -3.9296 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.9523 -3.4288 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.8190 -3.9296 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 21.5522 -3.9292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 22.4189 -3.4288 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.2856 -3.9292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 24.1524 -3.4288 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 20.6855 -3.4291 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 20.6853 -2.4285 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 20.9444 -4.3955 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 25.0191 -3.9290 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 24.1523 -2.4281 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 25.0189 -2.9286 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.0866 -4.9303 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.1528 -3.9296 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1528 -4.9304 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2859 -3.4293 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2859 -5.4309 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4193 -3.9296 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4193 -4.9304 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8863 -3.9296 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8863 -4.9304 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0194 -3.4293 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0194 -5.4309 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6198 -3.9296 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6198 -4.9304 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7529 -3.4293 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7529 -5.4309 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.4864 -3.4293 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.4864 -5.4309 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.4864 -2.4285 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 21.4890 -4.9303 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.6884 -5.4306 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.7878 -4.9303 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.9371 -5.4306 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.9371 -6.4314 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 22.3897 -5.4306 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.2402 -4.9303 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 24.0909 -5.4306 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 24.9915 -4.9303 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 25.8421 -5.4306 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 25.8421 -6.4314 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 26.7086 -6.9317 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 26.7086 -7.9324 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 25.8419 -8.4328 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 25.8419 -9.4335 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 24.9753 -9.9339 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 24.1087 -9.4335 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.2420 -9.9339 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.3754 -9.4335 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.5087 -9.9339 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.6421 -9.4335 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 4 1 1 0 0 0 5 4 1 0 0 0 7 6 1 0 0 0 8 7 1 0 0 0 9 8 1 0 0 0 5 10 1 0 0 0 10 6 1 0 0 0 10 11 2 0 0 0 10 12 1 0 0 0 9 13 1 0 0 0 9 14 1 0 0 0 9 15 1 0 0 0 1 16 1 6 0 0 19 17 1 0 0 0 20 18 1 0 0 0 21 19 1 0 0 0 22 20 1 0 0 0 22 21 1 0 0 0 25 23 1 0 0 0 26 24 1 0 0 0 17 25 1 0 0 0 18 26 1 0 0 0 29 27 1 0 0 0 30 28 1 0 0 0 23 29 1 0 0 0 24 30 1 0 0 0 27 31 1 0 0 0 28 32 1 0 0 0 31 3 1 0 0 0 31 33 2 0 0 0 34 35 1 0 0 0 35 36 1 0 0 0 36 37 1 0 0 0 37 16 1 0 0 0 37 38 2 0 0 0 34 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 2 0 0 0 43 44 1 0 0 0 44 45 1 0 0 0 45 46 2 0 0 0 46 47 1 0 0 0 47 48 1 0 0 0 48 49 2 0 0 0 49 50 1 0 0 0 50 51 1 0 0 0 51 52 1 0 0 0 52 53 1 0 0 0 53 54 1 0 0 0 M CHG 2 9 1 12 -1 M END > CHEBI:86121 > 1-hexadecanoyl-2-[(8Z,11Z,14Z)-eicosatrienoyl]-sn-glycero-3-phosphocholine > A phosphatidylcholine 36:3 in which the acyl group specified at positions 1 and 2 are hexadecanoyl and (8Z,11Z,14Z)-eicosatrienoyl respectively. > 3 > Phosphatidylcholine(16:0/20:3w6); Phosphatidylcholine(16:0/20:3n6); PC(16:0/20:3w6); PC(16:0/20:3n6); PC(16:0/20:3); PC(16:0/20:3(8Z,11Z,14Z)); GPCho(16:0/20:3w6); GPCho(16:0/20:3n6); GPCho(16:0/20:3); 1-Palmitoyl-2-homo-gamma-linolenoyl-sn-glycero-3-phosphocholine; 1-hexadecanoyl-2-(8Z,11Z,14Z-eicosatrienoyl)-sn-glycero-3-phosphocholine > (2R)-3-(hexadecanoyloxy)-2-{[(8Z,11Z,14Z)-icosa-8,11,14-trienoyl]oxy}propyl 2-(trimethylazaniumyl)ethyl phosphate > C44H82NO8P > 784.09750 > 783.57781 > 0 > CCCCCCCCCCCCCCCC(=O)OC[C@H](COP([O-])(=O)OCC[N+](C)(C)C)OC(=O)CCCCCC\C=C/C\C=C/C\C=C/CCCCC > InChI=1S/C44H82NO8P/c1-6-8-10-12-14-16-18-20-21-22-23-25-27-29-31-33-35-37-44(47)53-42(41-52-54(48,49)51-39-38-45(3,4)5)40-50-43(46)36-34-32-30-28-26-24-19-17-15-13-11-9-7-2/h14,16,20-21,23,25,42H,6-13,15,17-19,22,24,26-41H2,1-5H3/b16-14-,21-20-,25-23-/t42-/m1/s1 > SRIGHEHXEGELQJ-YYQUKWHJSA-N > LMGP01010627 $$$$