LMPR01070365 LIPID_MAPS_STRUCTURE_DATABASE 82 84 0 0 0 999 V2000 -12.9867 -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 -8.6305 -1.9417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7594 -1.4380 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8880 -1.9417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0169 -1.4380 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1458 -1.9417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2743 -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 -2.5317 -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 -0.7897 -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 -0.4301 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7594 -0.4301 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 -4.9369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.9867 -4.4363 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5179 -1.0042 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 -15.5757 -4.9333 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 -12.9760 -1.4450 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -12.1258 -3.9360 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -12.1258 -4.9333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7934 -1.0042 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 5.2363 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 -4.9333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1049 0.4782 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9736 0.9798 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8422 0.4782 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1049 -0.5247 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.7107 0.9798 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7107 1.9828 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8422 2.4842 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9736 1.9828 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1049 2.4842 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -17.3114 -5.9364 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.4425 -6.4380 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8104 -1.7115 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2255 -1.7115 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.5582 -2.2348 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.1432 -2.2348 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.5762 -5.9377 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.7099 -6.4380 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.8435 -5.9377 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.9771 -6.4380 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2389 1.9842 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.1109 -5.9379 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3728 2.4842 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5067 1.9842 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2448 -6.4379 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6407 2.4842 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7746 1.9842 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9086 2.4842 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0426 1.9842 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8234 2.4842 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3787 -5.9379 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5127 -6.4379 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6467 -5.9379 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7807 -6.4379 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9146 -5.9379 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0486 -6.4379 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1826 -5.9379 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3166 -6.4379 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6894 1.9842 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 44 54 1 0 0 0 54 55 1 0 0 0 37 39 1 1 0 0 26 56 1 6 0 0 26 57 1 1 0 0 21 58 1 1 0 0 21 59 1 6 0 0 55 60 1 0 0 0 60 61 1 0 0 0 61 62 1 0 0 0 62 63 1 0 0 0 53 64 1 0 0 0 63 65 1 0 0 0 64 66 1 0 0 0 66 67 1 0 0 0 65 68 1 0 0 0 67 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 1 0 0 0 68 74 1 0 0 0 74 75 1 0 0 0 75 76 1 0 0 0 76 77 1 0 0 0 77 78 1 0 0 0 78 79 1 0 0 0 79 80 1 0 0 0 80 81 1 0 0 0 73 82 1 0 0 0 M END > LMPR01070365 > Fucoxanthinol 3-stearate 3'-heptadecanoate > Fucoxanthinol 3-octadecanoate 3'-heptadecanoate > C75H122O7 > 1134.92 > Prenol Lipids [PR] > Isoprenoids [PR01] > C40 isoprenoids (tetraterpenes) [PR0107] > - > 17:0FOH18:0 > JYUNOVVPBNRSFR-FYACWDIASA-N > InChI=1S/C75H122O7/c1-13-15-17-19-21-23-25-27-29-31-33-35-37-39-41-53-70(78)81-66-57-72(9,10)75(74(12,59-66)82-75)60-67(76)64(6)51-45-50-62(4)47-43-42-46-61(3)48-44-49-63(5)54-55-68-71(7,8)56-65(58-73(68,11)79)80-69(77)52-40-38-36-34-32-30-28-26-24-22-20-18-16-14-2/h42-51,54,65-66,79H,13-41,52-53,56-60H2,1-12H3/b43-42+,48-44+,50-45+,61-46+,62-47+,63-49+,64-51+/t55-,65-,66-,73+,74+,75-/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)CCCCCCCCCCCCCCCC)C[C@]3(C)C)\C)O[C@]1(C)C[C@@H](OC(CCCCCCCCCCCCCCCCC)=O)C[C@@]2(C)C > - > - > - > - > - > - > 171121506 > - > - > - > - > - > 427924 > 28750733 $$$$