LMPR01070323 LIPID_MAPS_STRUCTURE_DATABASE 62 64 0 0 0 999 V2000 -13.3047 -0.3934 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.4360 1.0999 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.5674 1.6021 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.6988 1.0999 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8301 1.6021 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9616 1.0999 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0931 1.6021 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2244 1.0999 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3559 1.6021 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4874 1.0999 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6185 1.6021 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7500 1.0999 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8812 1.6021 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0128 1.0999 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1443 1.6021 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3601 2.4944 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.5674 2.6068 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0931 2.6068 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7500 0.0950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2757 0.0950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.1662 0.1021 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.0280 -0.3934 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.0280 -1.3874 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.1662 -1.8863 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.3047 -1.3874 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2216 1.9989 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0764 2.4944 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0764 3.4815 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2216 3.9733 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3601 3.4815 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.0245 0.5975 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0799 1.5036 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.3081 0.5975 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3636 1.5036 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.8861 -1.8827 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -12.4360 0.1091 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.2941 1.5951 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -12.4466 -0.8887 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -12.4466 -1.8827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5021 1.9989 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6440 1.5036 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9347 3.9768 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2757 1.0999 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3601 4.4723 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5021 3.9768 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -16.7514 -1.3831 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.7514 -0.3843 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -17.6165 -1.8827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -18.4824 -1.3827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -19.3483 -1.8827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -19.3483 -2.8826 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -18.4824 -3.3825 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -17.6165 -2.8826 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.7505 -3.3825 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.8845 -2.8826 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.0186 -3.3825 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.1527 -2.8826 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.2866 -3.3825 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.4207 -2.8826 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.5548 -3.3825 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.6889 -2.8826 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8229 -3.3825 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 21 31 1 0 0 0 26 32 1 0 0 0 21 33 1 0 0 0 26 34 1 0 0 0 23 35 1 1 0 0 2 36 1 0 0 0 37 2 2 0 0 0 1 38 1 6 0 0 25 38 1 6 0 0 1 36 1 1 0 0 25 39 1 1 0 0 16 40 2 0 0 0 40 41 2 0 0 0 28 42 1 1 0 0 41 43 1 1 0 0 15 43 2 0 0 0 20 43 1 0 0 0 30 44 1 1 0 0 30 45 1 6 0 0 35 46 1 0 0 0 46 47 2 0 0 0 46 48 1 0 0 0 48 49 1 0 0 0 49 50 1 0 0 0 51 52 1 0 0 0 52 53 1 0 0 0 50 51 1 0 0 0 53 54 1 0 0 0 54 55 1 0 0 0 55 56 2 0 0 0 56 57 1 0 0 0 57 58 1 0 0 0 58 59 1 0 0 0 59 60 1 0 0 0 60 61 1 0 0 0 61 62 1 0 0 0 M END > LMPR01070323 > Fucoxanthinol 3-(9E-hexadecenoate) > Fucoxanthinol 3-(9E-hexadecenoate) > C56H84O6 > 852.63 > Prenol Lipids [PR] > Isoprenoids [PR01] > C40 isoprenoids (tetraterpenes) [PR0107] > - > FOH-3-C16:1; FOH16:1 > LRRONDIEVKPHQF-ZFFLDDIHSA-N > InChI=1S/C56H84O6/c1-12-13-14-15-16-17-18-19-20-21-22-23-24-35-51(59)61-48-40-53(8,9)56(55(11,41-48)62-56)42-49(58)46(5)34-28-33-44(3)30-26-25-29-43(2)31-27-32-45(4)36-37-50-52(6,7)38-47(57)39-54(50,10)60/h17-18,25-34,36,47-48,57,60H,12-16,19-24,35,38-42H2,1-11H3/b18-17+,26-25+,31-27+,33-28+,43-29+,44-30+,45-32+,46-34+/t37-,47-,48-,54+,55+,56-/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=[C@@]=C3[C@@](O)(C)C[C@@H](O)CC3(C)C)O[C@]1(C)C[C@@H](OC(CCCCCCC/C=C/CCCCCC)=O)CC2(C)C > - > - > - > - > - > - > 171121478 > - > - > - > - > - > 427924 > 28750733 $$$$