LMGP01020367 LIPID_MAPS_STRUCTURE_DATABASE 54 53 0 0 0 0 0 0 0 0999 V2000 -2.5579 0.5637 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4321 1.0670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3066 0.5637 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0525 -0.3105 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0632 -0.3105 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6834 1.0686 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8090 0.5637 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3556 0.5428 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2300 0.0378 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1045 0.5428 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9788 0.0378 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8533 0.5428 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9788 -0.9719 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8533 -0.4669 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4351 0.9174 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 -0.0103 0.1454 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4351 1.8382 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9791 -0.8272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9791 -1.8382 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8533 -0.3221 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7339 -0.8272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6151 -0.3221 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4963 -0.8272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3776 -0.3221 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2588 -0.8272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.1400 -0.3221 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.0212 -0.8272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.9024 -0.8272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.7836 -0.3221 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.6649 -0.8272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.5461 -0.8272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.4273 -0.3221 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.3085 -0.8272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -17.1897 -0.8272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -18.0709 -0.3221 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -18.9522 -0.8272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1880 1.0670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0693 0.5637 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9505 1.0670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8317 0.5637 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7129 1.0670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5941 0.5637 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.4753 1.0670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.3566 0.5637 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.2378 1.0670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.1190 1.0670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.0002 0.5637 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.8814 1.0670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.7626 1.0670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.6439 0.5637 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -17.5251 1.0670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -18.4063 1.0670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -19.2875 0.5637 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -20.1687 1.0670 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 1 0 0 0 0 26 27 1 0 0 0 0 27 28 2 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 30 31 2 0 0 0 0 31 32 1 0 0 0 0 32 33 1 0 0 0 0 33 34 2 0 0 0 0 34 35 1 0 0 0 0 35 36 1 0 0 0 0 3 37 1 0 0 0 0 37 38 1 0 0 0 0 38 39 1 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 2 0 0 0 0 46 47 1 0 0 0 0 47 48 1 0 0 0 0 48 49 2 0 0 0 0 49 50 1 0 0 0 0 50 51 1 0 0 0 0 51 52 2 0 0 0 0 52 53 1 0 0 0 0 53 54 1 0 0 0 0 M CHG 2 11 1 16 -1 M END > LMGP01020367 > PC O-18:3(9Z,12Z,15Z)/18:3(9Z,12Z,15Z) > 1-(9Z,12Z,15Z-octadecatrienyl)-2-(9Z,12Z,15Z-octadecatrienoyl)-sn-glycero-3-phosphocholine > C44H78NO7P > 763.55 > Glycerophospholipids [GP] > Glycerophosphocholines [GP01] > 1-alkyl,2-acylglycerophosphocholines [GP0102] > - > > UCCKRFLYRWRGGT-IXVJYKGQSA-N > InChI=1S/C44H78NO7P/c1-6-8-10-12-14-16-18-20-22-24-26-28-30-32-34-36-39-49-41-43(42-51-53(47,48)50-40-38-45(3,4)5)52-44(46)37-35-33-31-29-27-25-23-21-19-17-15-13-11-9-7-2/h8-11,14-17,20-23,43H,6-7,12-13,18-19,24-42H2,1-5H3/b10-8-,11-9-,16-14-,17-15-,22-20-,23-21-/t43-/m1/s1 > [C@](COP(=O)([O-])OCC[N+](C)(C)C)([H])(OC(CCCCCCC/C=C\C/C=C\C/C=C\CC)=O)COCCCCCCCC/C=C\C/C=C\C/C=C\CC > - > - > - > PC O-36:6 > - > - > - > - > - > - > - > - > 10090 > 40790030 $$$$