LMGP06020084 LIPID_MAPS_STRUCTURE_DATABASE 63 63 0 0 0 999 V2000 -3.2889 0.4504 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1756 0.9607 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0625 0.4504 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7764 -0.4364 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8015 -0.4364 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4020 0.9624 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5152 0.4504 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9042 0.4238 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1247 0.8038 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 -0.4811 0.0208 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1247 1.7376 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7304 -0.9605 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7304 -1.9859 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.6169 -0.4483 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0347 2.7696 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0662 2.1740 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0662 0.9828 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0347 0.3872 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0031 0.9828 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0031 2.1740 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0347 3.9609 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0978 0.3872 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0347 -0.8041 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1608 3.0163 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0978 2.7696 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.4141 -0.9605 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2110 -0.4483 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0080 -0.4483 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8049 -0.9605 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.6018 -0.4483 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3988 -0.4483 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.1957 -0.9605 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.9926 -0.4483 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.7896 -0.4483 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.5865 -0.9605 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.3834 -0.4483 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.1804 -0.4483 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.9773 -0.9605 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.7742 -0.4483 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -17.5712 -0.4483 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -18.3681 -0.9605 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -19.1650 -0.4483 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -19.9620 -0.4483 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -20.7589 -0.9605 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -21.5558 -0.4483 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8596 0.9607 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6565 0.4504 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4534 0.9607 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2504 0.4504 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0473 0.9607 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8442 0.4504 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.6412 0.9607 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.4381 0.4504 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.2350 0.9607 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.0320 0.4504 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.8289 0.9607 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.6258 0.4504 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.4228 0.9607 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.2197 0.4504 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -17.0166 0.9607 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -17.8136 0.4504 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -18.6105 0.9607 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -19.4074 0.4504 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 6 1 1 0 0 0 0 7 6 1 0 0 0 0 9 8 1 0 0 0 0 9 10 1 0 0 0 0 9 11 2 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 12 5 1 0 0 0 0 7 9 1 0 0 0 0 1 5 1 6 0 0 0 1 4 1 1 0 0 0 15 16 1 0 0 0 0 16 17 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 15 1 0 0 0 0 15 21 1 1 0 0 0 17 22 1 1 0 0 0 18 23 1 1 0 0 0 20 24 1 6 0 0 0 16 25 1 6 0 0 0 19 8 1 1 0 0 0 14 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 36 37 2 0 0 0 0 37 38 1 0 0 0 0 38 39 1 0 0 0 0 39 40 2 0 0 0 0 40 41 1 0 0 0 0 41 42 1 0 0 0 0 42 43 2 0 0 0 0 43 44 1 0 0 0 0 44 45 1 0 0 0 0 3 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 55 56 1 0 0 0 0 56 57 1 0 0 0 0 57 58 1 0 0 0 0 58 59 1 0 0 0 0 59 60 1 0 0 0 0 60 61 1 0 0 0 0 61 62 1 0 0 0 0 62 63 1 0 0 0 0 M END > LMGP06020084 > PI O-18:0/22:6(4Z,7Z,10Z,13Z,16Z,19Z) > 1-octadecyl-2-(4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl)-glycero-3-phospho-(1'-myo-inositol) > C49H85O12P > 896.58 > Glycerophospholipids [GP] > Glycerophosphoinositols [GP06] > 1-alkyl,2-acylglycerophosphoinositols [GP0602] > - > PI(O-40:6); PI(O-18:0/22:6) > CPWBMXQIYVQUOY-FHVNXMMOSA-N > InChI=1S/C49H85O12P/c1-3-5-7-9-11-13-15-17-19-21-22-23-24-26-28-30-32-34-36-38-43(50)60-42(41-59-62(56,57)61-49-47(54)45(52)44(51)46(53)48(49)55)40-58-39-37-35-33-31-29-27-25-20-18-16-14-12-10-8-6-4-2/h5,7,11,13,17,19,22-23,26,28,32,34,42,44-49,51-55H,3-4,6,8-10,12,14-16,18,20-21,24-25,27,29-31,33,35-41H2,1-2H3,(H,56,57)/b7-5-,13-11-,19-17-,23-22-,28-26-,34-32-/t42-,44-,45-,46+,47-,48-,49-/m1/s1 > [C@]([H])(OC(CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CC)=O)(COP(=O)(O)O[C@H]1[C@H](O)[C@@H](O)[C@H](O)[C@@H](O)[C@H]1O)COCCCCCCCCCCCCCCCCCC > - > - > - > PI O-40:6 > - > SLM:000053436 > 178330288 > - > - > - > - > - > - > - $$$$