LMPR01070349 LIPID_MAPS_STRUCTURE_DATABASE 81 83 0 0 0 999 V2000 -12.9866 -3.4394 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.1151 -1.9417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2439 -1.4380 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3728 -1.9417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5015 -1.4380 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6303 -1.9417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7593 -1.4380 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8879 -1.9417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0168 -1.4380 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1456 -1.9417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2742 -1.4380 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4030 -1.9417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5318 -1.4380 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6606 -1.9417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7896 -1.4380 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6538 -0.5071 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2439 -0.4302 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7593 -0.4302 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4030 -2.9495 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0816 -2.9495 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.8506 -2.9424 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.7149 -3.4394 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.7149 -4.4363 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.8506 -4.9368 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.9866 -4.4363 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5179 -1.0043 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3755 -0.5071 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3755 0.4829 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5179 0.9763 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6538 0.4829 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.5756 -4.9332 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -12.1151 -2.9354 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.9759 -1.4450 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -12.1258 -3.9361 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -12.1258 -4.9332 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7934 -1.0043 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9326 -1.5009 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2361 0.9798 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0816 -1.9417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6538 1.4767 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7934 0.9798 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -16.4434 -4.4320 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.4434 -3.4303 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -17.3114 -4.9332 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1047 0.4782 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9735 0.9798 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8421 0.4782 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1047 -0.5247 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.7105 0.9798 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7105 1.9828 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8421 2.4843 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9735 1.9828 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1047 2.4843 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2361 1.9828 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8105 -1.7116 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2253 -1.7116 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.5581 -2.2348 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.1431 -2.2348 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3699 2.4830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5035 1.9828 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6373 2.4830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7711 1.9828 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9048 2.4830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0385 1.9828 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8277 2.4830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -17.3114 -5.9335 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.4451 -6.4336 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.5788 -5.9335 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.7126 -6.4336 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.8463 -5.9335 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.9801 -6.4336 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.1138 -5.9335 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.1135 -5.9335 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.2473 -6.4336 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3810 -5.9335 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3808 -5.9335 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5145 -6.4336 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6482 -5.9335 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6479 -5.9335 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7817 -6.4336 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9155 -5.9335 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2 3 1 0 0 0 3 4 2 0 0 0 4 5 1 0 0 0 5 6 2 0 0 0 6 7 1 0 0 0 7 8 2 0 0 0 8 9 1 0 0 0 9 10 2 0 0 0 10 11 1 0 0 0 11 12 2 0 0 0 12 13 1 0 0 0 13 14 2 0 0 0 14 15 1 0 0 0 3 17 1 0 0 0 7 18 1 0 0 0 12 19 1 0 0 0 21 1 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 1 1 0 0 0 26 16 1 0 0 0 26 27 1 0 0 0 27 28 1 0 0 0 28 29 1 0 0 0 29 30 1 0 0 0 16 30 1 0 0 0 23 31 1 1 0 0 2 32 1 0 0 0 33 2 2 0 0 0 1 34 1 6 0 0 25 34 1 6 0 0 1 32 1 1 0 0 25 35 1 1 0 0 16 36 2 0 0 0 36 37 2 0 0 0 28 38 1 1 0 0 15 39 2 0 0 0 20 39 1 0 0 0 30 40 1 1 0 0 30 41 1 6 0 0 31 42 1 0 0 0 42 43 2 0 0 0 42 44 1 0 0 0 38 45 1 0 0 0 45 46 1 0 0 0 46 47 1 0 0 0 45 48 2 0 0 0 47 49 1 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 37 39 1 1 0 0 26 55 1 6 0 0 26 56 1 1 0 0 21 57 1 1 0 0 21 58 1 6 0 0 54 59 1 0 0 0 59 60 1 0 0 0 60 61 1 0 0 0 61 62 1 0 0 0 62 63 1 0 0 0 63 64 1 0 0 0 64 65 1 0 0 0 44 66 1 0 0 0 66 67 1 0 0 0 67 68 1 0 0 0 68 69 1 0 0 0 69 70 1 0 0 0 70 71 1 0 0 0 71 72 1 0 0 0 72 73 2 0 0 0 73 74 1 0 0 0 74 75 1 0 0 0 75 76 2 0 0 0 76 77 1 0 0 0 77 78 1 0 0 0 78 79 2 0 0 0 79 80 1 0 0 0 80 81 1 0 0 0 M END > LMPR01070349 > Fucoxanthinol 3-linolenate 3'-palmitate > Fucoxanthinol 3-(9Z,12Z,15Z-octadecatrienoate) 3'-hexadecanoate > C74H114O7 > 1114.86 > Prenol Lipids [PR] > Isoprenoids [PR01] > C40 isoprenoids (tetraterpenes) [PR0107] > - > 16:0FOH18:3 > UVJNVWOQQDYWQV-TWJYVPJTSA-N > InChI=1S/C74H114O7/c1-13-15-17-19-21-23-25-27-28-30-32-34-36-38-40-52-69(77)80-65-56-71(9,10)74(73(12,58-65)81-74)59-66(75)63(6)50-44-49-61(4)46-42-41-45-60(3)47-43-48-62(5)53-54-67-70(7,8)55-64(57-72(67,11)78)79-68(76)51-39-37-35-33-31-29-26-24-22-20-18-16-14-2/h15,17,21,23,27-28,41-50,53,64-65,78H,13-14,16,18-20,22,24-26,29-40,51-52,55-59H2,1-12H3/b17-15-,23-21-,28-27-,42-41+,47-43+,49-44+,60-45+,61-46+,62-48+,63-50+/t54-,64-,65-,72+,73+,74-/m0/s1 > [C@@]12(CC(=O)/C(/C)=C/C=C/C(/C)=C/C=C/C=C(\C)/C=C/C=C(/C=[C@@]=C3[C@@](O)(C)C[C@@H](OC(=O)CCCCCCCCCCCCCCC)C[C@]3(C)C)\C)O[C@]1(C)C[C@@H](OC(CCCCCCC/C=C\C/C=C\C/C=C\CC)=O)C[C@@]2(C)C > - > - > - > - > - > - > 171121498 > - > - > - > - > - > 427924 > 28750733 $$$$