LMPR01080023 LIPID_MAPS_STRUCTURE_DATABASE 51 50 0 0 0 999 V2000 16.7990 -15.5384 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.6487 -15.0386 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.5480 -15.5384 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.3976 -15.0386 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.2472 -15.5384 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.1467 -15.0386 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.9961 -15.5384 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.8458 -15.0386 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.7452 -15.5384 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 24.5947 -15.0386 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 25.4442 -15.5384 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 26.3436 -15.0386 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 27.1932 -15.5384 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 28.0427 -15.0386 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 28.8923 -15.5384 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 29.7917 -15.0386 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 30.6413 -15.5384 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 31.4908 -15.0386 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.3976 -14.0391 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.8458 -14.0391 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 27.1932 -16.5377 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 30.6413 -16.5377 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.9496 -15.0386 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0500 -15.5384 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2005 -15.0386 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3511 -15.5384 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.9496 -14.0391 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 32.3403 -15.5384 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 33.2398 -15.0386 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 34.0893 -15.5384 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 34.9387 -15.0386 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 35.8383 -15.5384 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 36.6879 -15.0386 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 37.5373 -15.5384 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 38.4368 -15.0386 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 34.0893 -16.5377 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 37.5373 -16.5377 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4857 -15.0484 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6256 -15.5548 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4774 -14.0531 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6164 -14.5465 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3596 -16.5622 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2259 -17.0528 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2346 -18.0674 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1227 -18.5703 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3836 -18.5687 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 36.6879 -14.0348 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 37.5494 -13.5376 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 37.5494 -12.5338 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 38.4067 -12.0389 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 36.6799 -12.0317 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 2 3 2 0 0 0 3 4 1 0 0 0 4 5 2 0 0 0 5 6 1 0 0 0 6 7 2 0 0 0 7 8 1 0 0 0 8 9 2 0 0 0 9 10 1 0 0 0 10 11 2 0 0 0 11 12 1 0 0 0 12 13 2 0 0 0 13 14 1 0 0 0 14 15 2 0 0 0 15 16 1 0 0 0 16 17 2 0 0 0 17 18 1 0 0 0 4 19 1 0 0 0 8 20 1 0 0 0 13 21 1 0 0 0 17 22 1 0 0 0 1 23 2 0 0 0 23 24 1 0 0 0 24 25 2 0 0 0 25 26 1 0 0 0 23 27 1 0 0 0 18 28 2 0 0 0 28 29 1 0 0 0 29 30 2 0 0 0 30 31 1 0 0 0 31 32 2 0 0 0 32 33 1 0 0 0 33 34 2 0 0 0 34 35 1 0 0 0 30 36 1 0 0 0 34 37 1 0 0 0 26 38 1 0 0 0 38 39 1 0 0 0 38 40 1 0 0 0 38 41 1 0 0 0 26 42 1 0 0 0 42 43 1 0 0 0 43 44 2 0 0 0 44 45 1 0 0 0 44 46 1 0 0 0 33 47 1 0 0 0 47 48 1 0 0 0 48 49 2 0 0 0 49 50 1 0 0 0 49 51 1 0 0 0 M END > LMPR01080023 > Trisanhydrobacterioruberin > 2,2'-Bis(3-methylbut-2-enyl)-3,4,3',4'-tetradehydro-1,2-dihydro-psi,psi-caroten-1-ol > C50H70O > 686.54 > Prenol Lipids [PR] > Isoprenoids [PR01] > Polyterpenes [PR0108] > - > > ITKQGMYWKIZFRV-IHSOVVFFSA-N > InChI=1S/C50H70O/c1-39(2)31-35-48(41(5)6)36-33-46(11)29-19-27-44(9)25-17-23-42(7)21-15-16-22-43(8)24-18-26-45(10)28-20-30-47(12)34-38-49(50(13,14)51)37-32-40(3)4/h15-34,36,38,49,51H,35,37H2,1-14H3/b16-15+,23-17+,24-18+,27-19+,28-20+,36-33+,38-34+,42-21+,43-22+,44-25+,45-26+,46-29+,47-30+ > C(=C(/C)\C=C\C(C/C=C(\C)/C)C(C)(O)C)/C=C/C(/C)=C/C=C/C(/C)=C/C=C/C=C(\C)/C=C/C=C(\C)/C=C/C=C(\C)/C=C/C(/C/C=C(\C)/C)=C(\C)/C > - > - > - > - > - > - > 171121278 > - > - > - > - > - > 2242 > 22805960 $$$$