LMPR01070731 LIPID_MAPS_STRUCTURE_DATABASE 44 47 0 0 0 999 V2000 -3.4683 -10.9174 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4683 -11.9031 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6148 -12.3960 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7611 -11.9031 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7611 -10.9174 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6148 -10.4246 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8899 -10.4246 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0362 -10.9174 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8173 -10.4246 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6709 -10.9174 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5246 -10.4246 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3781 -10.9174 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2316 -10.4246 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0853 -10.9174 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9388 -10.4246 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7925 -10.9174 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6461 -10.4246 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4997 -10.9174 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3532 -10.4246 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2068 -10.9174 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0604 -10.4246 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9140 -10.9174 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1077 -9.5711 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1220 -9.5711 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7629 -10.4274 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6022 -10.9120 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4393 -10.4288 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2774 -10.9127 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.1311 -10.4200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.1312 -9.4343 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2929 -8.9504 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4393 -9.4432 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9140 -11.9031 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4997 -11.9031 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8173 -9.4390 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2316 -9.4391 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5931 -8.9544 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3215 -12.3957 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.7695 -11.7650 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7853 -11.7650 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8976 -11.4160 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8976 -12.4017 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7629 -9.4303 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.9996 -8.9328 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 2 3 1 0 0 0 3 4 1 0 0 0 4 5 1 0 0 0 5 6 1 0 0 0 1 6 1 0 0 0 5 7 1 1 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 15 16 2 0 0 0 16 17 1 0 0 0 17 18 2 0 0 0 18 19 1 0 0 0 19 20 2 0 0 0 20 21 1 0 0 0 21 22 2 0 0 0 6 23 1 0 0 0 6 24 1 0 0 0 22 25 1 0 0 0 25 26 1 0 0 0 27 26 2 0 0 0 27 28 1 0 0 0 28 29 1 0 0 0 29 30 1 0 0 0 30 31 1 0 0 0 31 32 1 0 0 0 27 32 1 0 0 0 22 33 1 0 0 0 18 34 1 0 0 0 9 35 1 0 0 0 13 36 1 0 0 0 32 37 1 1 0 0 2 38 1 1 0 0 28 39 1 0 0 0 28 40 1 0 0 0 5 41 1 6 0 0 4 41 1 6 0 0 4 42 1 1 0 0 25 43 1 1 0 0 32 43 1 6 0 0 30 44 1 1 0 0 M END > LMPR01070731 > (8'S)-Luteoxanthin > (3S,5R,6S,3'S,5'R,8'S)-5,6:5',8'-Diepoxy-5,6,5',8'-tetrahydro-beta,beta-carotene-3,3'-diol > C40H56O4 > 600.42 > Prenol Lipids [PR] > Isoprenoids [PR01] > C40 isoprenoids (tetraterpenes) [PR0107] > - > > YNNRPBRNWWIQPQ-QGYVNDQGSA-N > InChI=1S/C40H56O4/c1-28(17-13-18-30(3)21-22-40-37(7,8)25-33(42)27-39(40,10)44-40)15-11-12-16-29(2)19-14-20-31(4)34-23-35-36(5,6)24-32(41)26-38(35,9)43-34/h11-23,32-34,41-42H,24-27H2,1-10H3/b12-11+,17-13+,19-14+,22-21+,28-15+,29-16+,30-18+,31-20+/t32-,33-,34-,38+,39+,40-/m0/s1 > C1C(C)(C)[C@@]2(O[C@]2(C)C[C@H]1O)/C=C/C(/C)=C/C=C/C(/C)=C/C=C/C=C(\C)/C=C/C=C(\C)/[C@H]1O[C@@]2(C)C(C(C)(C)C[C@H](O)C2)=C1 > - > - > - > - > - > - > 162861648 > - > - > - > - > - > 74629 > - $$$$