LMPR01070733 LIPID_MAPS_STRUCTURE_DATABASE 44 47 0 0 0 999 V2000 -1.8821 -10.6356 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8821 -11.6073 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0407 -12.0931 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1992 -11.6073 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1992 -10.6356 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0407 -10.1499 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6596 -10.1499 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5011 -10.6356 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3424 -10.1499 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1839 -10.6356 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0254 -10.1499 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8667 -10.6356 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7080 -10.1499 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5495 -10.6356 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3908 -10.1499 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2323 -10.6356 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0738 -10.1499 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9152 -10.6356 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7565 -10.1499 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5980 -10.6356 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4394 -10.1499 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2808 -10.6356 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5266 -9.3085 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5550 -9.3085 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1176 -10.1526 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9449 -10.6303 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7701 -10.1540 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.5962 -10.6310 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.4377 -10.1453 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.4378 -9.1737 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.6115 -8.6967 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7701 -9.1825 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2808 -11.6073 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9152 -11.6073 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3424 -9.1783 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7080 -9.1784 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9360 -8.7007 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.0813 -11.4711 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.1112 -11.4711 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1176 -9.1697 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4717 -11.6073 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7123 -12.0868 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2922 -12.4585 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.2939 -8.6793 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 2 0 0 0 7 8 1 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 28 38 1 0 0 0 28 39 1 0 0 0 25 40 1 1 0 0 32 40 1 6 0 0 4 41 1 6 0 0 8 41 1 6 0 0 2 42 1 1 0 0 4 43 1 1 0 0 30 44 1 1 0 0 M END > LMPR01070733 > (8R,8'S)-Auroxanthin > (3S,5R,8R,3'S,5'R,8'S)-5,8,5',8'-tetrahydro-beta,beta-carotene-3,3'diol > C40H56O4 > 600.42 > Prenol Lipids [PR] > Isoprenoids [PR01] > C40 isoprenoids (tetraterpenes) [PR0107] > - > > YLUSVJDFTAATNS-QEWYVUGISA-N > InChI=1S/C40H56O4/c1-27(17-13-19-29(3)33-21-35-37(5,6)23-31(41)25-39(35,9)43-33)15-11-12-16-28(2)18-14-20-30(4)34-22-36-38(7,8)24-32(42)26-40(36,10)44-34/h11-22,31-34,41-42H,23-26H2,1-10H3/b12-11+,17-13+,18-14+,27-15+,28-16+,29-19+,30-20+/t31-,32-,33-,34+,39+,40+/m0/s1 > C1C(C)(C)C2=C[C@@H](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@H]1O[C@@]2(C)C(C(C)(C)C[C@H](O)C2)=C1 > - > - > - > - > - > - > 163007069 > - > - > - > - > - > 74629 > - $$$$