LMPR01070305 LIPID_MAPS_STRUCTURE_DATABASE 62 64 0 0 0 999 V2000 -13.3417 -0.6426 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.4725 0.8511 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.6036 1.3535 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.7346 0.8511 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8656 1.3535 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9967 0.8511 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1276 1.3535 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2585 0.8511 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3896 1.3535 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5206 0.8511 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6514 1.3535 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7827 0.8511 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9135 1.3535 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0447 0.8511 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1758 1.3535 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4325 2.3527 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.6036 2.3587 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1276 2.3587 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7827 -0.1541 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3069 -0.1541 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.2036 -0.1470 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.0656 -0.6426 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.0656 -1.6371 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.2036 -2.1361 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.3417 -1.6371 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2943 1.8571 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1496 2.3527 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1496 3.3404 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2943 3.8324 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4325 3.3404 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.0622 0.3486 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1531 1.3615 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.3451 0.3486 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4359 1.3615 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.9241 -2.1326 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -12.4725 -0.1399 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.3311 1.3465 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -12.4831 -1.1381 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -12.4831 -2.1326 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5740 1.8571 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7467 1.3615 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0082 3.8359 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3069 0.8511 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4325 4.3315 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5740 3.8359 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -16.7903 -1.6326 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.7903 -0.6325 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -17.6564 -2.1326 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -18.5224 -1.6326 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -19.3885 -2.1326 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -19.3885 -3.1328 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -18.5224 -3.6328 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -17.6564 -3.1328 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.7903 -3.6328 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.9241 -3.1328 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.0580 -3.6328 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.1919 -3.1328 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.3258 -3.6328 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.4596 -3.1328 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.5935 -3.6328 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.7274 -3.1328 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8614 -3.6328 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 50 51 1 0 0 0 51 52 1 0 0 0 52 53 1 0 0 0 53 54 1 0 0 0 54 55 1 0 0 0 55 56 1 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 > LMPR01070305 > Fucoxanthinol 3-palmitate > Fucoxanthinol 3-hexadecanoate > C56H86O6 > 854.64 > Prenol Lipids [PR] > Isoprenoids [PR01] > C40 isoprenoids (tetraterpenes) [PR0107] > - > FOH-3-C16:0; FOH16:0 > DOOSGBSANNYKHN-AKGADZGASA-N > InChI=1S/C56H86O6/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/h25-34,36,47-48,57,60H,12-24,35,38-42H2,1-11H3/b26-25+,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(CCCCCCCCCCCCCCC)=O)CC2(C)C > - > - > - > - > - > - > 171121463 > - > - > - > - > - > 339787 > 17263549 $$$$