Ketcher 06221511002D 1 1.00000 0.00000 0 54 53 0 1 0 999 V2000 12.2829 -5.4362 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4172 -4.9376 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5514 -5.4362 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.1487 -4.9358 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0149 -5.4362 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.7466 -5.4358 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.6130 -4.9358 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.4791 -5.4358 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.3451 -4.9358 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.8807 -4.9361 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 14.8806 -3.9363 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.1395 -5.9019 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.3451 -3.9360 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.2112 -4.4360 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.2112 -5.4358 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2837 -6.4362 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.1497 -6.9363 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0158 -6.4362 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1497 -7.9362 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.8818 -6.9363 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7479 -6.4362 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.6139 -6.9363 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.4799 -6.4362 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.3460 -6.9363 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.2120 -6.4362 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.0781 -6.9363 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.9441 -6.4362 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.9441 -5.4361 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.8102 -4.9361 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.8102 -3.9361 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.9441 -3.4362 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.9441 -2.4361 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.0781 -1.9361 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.2120 -2.4361 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.3460 -1.9361 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7567 -4.9357 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8908 -5.4357 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6853 -4.9361 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8192 -5.4361 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6853 -3.9362 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.9531 -4.9361 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0869 -5.4360 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2210 -4.9358 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3550 -5.4358 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4888 -4.9358 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6227 -5.4357 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8907 -6.4359 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0245 -6.9357 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1720 -6.9354 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3059 -6.4354 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4397 -6.9356 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5737 -6.4354 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7077 -6.9357 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1584 -6.4356 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 17 18 1 0 0 0 17 19 2 0 0 0 18 20 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 27 26 2 0 0 0 28 27 1 0 0 0 29 28 1 0 0 0 30 29 2 0 0 0 31 30 1 0 0 0 32 31 1 0 0 0 33 32 2 0 0 0 34 33 1 0 0 0 35 34 1 0 0 0 17 16 1 0 0 0 46 36 1 0 0 0 36 37 2 0 0 0 47 37 1 0 0 0 38 39 1 0 0 0 38 40 2 0 0 0 39 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 47 48 1 0 0 0 50 49 1 0 0 0 51 50 1 0 0 0 52 51 1 0 0 0 53 52 1 0 0 0 54 53 1 0 0 0 48 54 1 0 0 0 38 3 1 0 0 0 M CHG 2 9 1 12 -1 M END > CHEBI:86133 > 1-[(9Z)-octadecenoyl]-2-[(9Z,12Z,15Z)-octadecatrienoyl]-sn-glycero-3-phosphocholine > A phosphatidylcholine 36:4 in which the acyl groups specified at positions 1 and 2 are (9Z)-octadecenoyl and (9Z,12Z,15Z)-octadecatrienoyl respectively. > 3 > Phosphatidylcholine(18:1w9/18:3w3); Phosphatidylcholine(18:1n9/18:3n3); Phosphatidylcholine(18:1/18:3); PC(18:1w9/18:3w3); PC(18:1n9/18:3n3); PC(18:1/18:3); PC(18:1(9Z)/18:3(9Z,12Z,15Z)); GPCho(18:1w9/18:3w3); GPCho(18:1n9/18:3n3); GPCho(18:1/18:3); 1-Oleoyl-2-alpha-linolenoyl-sn-glycero-3-phosphocholine; 1-(9Z-octadecaenoyl)-2-(9Z,12Z,15Z-octadecatrienoyl)-sn-glycero-3-phosphocholine > (2R)-2-{[(9Z,12Z,15Z)-octadeca-9,12,15-trienoyl]oxy}-3-{[(9Z)-octadec-9-enoyl]oxy}propyl 2-(trimethylazaniumyl)ethyl phosphate > C44H80NO8P > 782.08170 > 781.56216 > 0 > CCCCCCCC\C=C/CCCCCCCC(=O)OC[C@H](COP([O-])(=O)OCC[N+](C)(C)C)OC(=O)CCCCCCC\C=C/C\C=C/C\C=C/CC > InChI=1S/C44H80NO8P/c1-6-8-10-12-14-16-18-20-22-24-26-28-30-32-34-36-43(46)50-40-42(41-52-54(48,49)51-39-38-45(3,4)5)53-44(47)37-35-33-31-29-27-25-23-21-19-17-15-13-11-9-7-2/h9,11,15,17,20-23,42H,6-8,10,12-14,16,18-19,24-41H2,1-5H3/b11-9-,17-15-,22-20-,23-21-/t42-/m1/s1 > FVQGNFUBHWGFCY-HJOYQDMMSA-N > LMGP01010898 $$$$