LMPR01071021 LIPID_MAPS_STRUCTURE_DATABASE 46 47 0 0 0 999 V2000 21.5297 -10.0424 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.7721 -11.8172 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.5770 -11.3142 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3143 -12.8737 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3143 -13.8799 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1696 -14.3831 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0248 -13.8799 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0248 -12.8737 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1696 -12.3706 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9305 -12.3706 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6665 -11.5153 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6727 -11.5153 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9305 -14.3831 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4590 -14.3831 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9366 -11.8172 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7919 -11.3644 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6471 -11.8172 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5025 -11.3644 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3577 -11.8172 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2634 -11.3644 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1186 -11.8172 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9739 -11.3644 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8292 -11.8172 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6845 -11.3644 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5398 -11.8172 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.3950 -11.3644 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2503 -11.8172 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.1559 -11.3644 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.0112 -11.8172 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.8665 -11.3644 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.0112 -12.8235 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5398 -12.8235 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7919 -10.3582 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2634 -10.3582 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.4651 -11.7860 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 22.3117 -9.4287 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.9695 -8.4953 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.9762 -8.5322 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.7043 -9.4884 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.8268 -10.7453 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.1726 -8.9315 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.2719 -9.6858 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.3742 -7.7655 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.6557 -9.8595 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 19.8548 -10.3623 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5683 -13.8789 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2 3 1 0 0 0 4 5 1 0 0 0 5 6 1 0 0 0 6 7 1 0 0 0 7 8 2 0 0 0 8 9 1 0 0 0 4 9 1 0 0 0 8 10 1 0 0 0 9 11 1 0 0 0 9 12 1 0 0 0 7 13 1 0 0 0 5 14 1 0 0 0 15 16 1 0 0 0 16 17 2 0 0 0 17 18 1 0 0 0 18 19 2 0 0 0 19 20 1 0 0 0 20 21 2 0 0 0 21 22 1 0 0 0 22 23 2 0 0 0 23 24 1 0 0 0 24 25 2 0 0 0 25 26 1 0 0 0 26 27 2 0 0 0 27 28 1 0 0 0 28 29 2 0 0 0 29 30 1 0 0 0 29 31 1 0 0 0 25 32 1 0 0 0 16 33 1 0 0 0 20 34 1 0 0 0 10 15 3 0 0 0 30 2 2 0 0 0 3 35 2 0 0 0 1 3 1 0 0 0 1 36 1 0 0 0 36 37 1 0 0 0 37 38 1 0 0 0 38 39 1 0 0 0 1 39 1 0 0 0 1 40 1 0 0 0 36 41 1 0 0 0 36 42 1 0 0 0 38 43 1 0 0 0 33 44 1 0 0 0 30 45 1 0 0 0 14 46 1 0 0 0 M END > LMPR01071021 > Agelaxanthin C > 19,3',8'-Trihydroxy-3-methoxy-7,8-didehydro-beta,kappa-caroten-6'-one > C41H56O5 > 628.41 > Prenol Lipids [PR] > Isoprenoids [PR01] > C40 isoprenoids (tetraterpenes) [PR0107] > - > > PUKIMUCQDWXVFJ-XUCUYSFRSA-N > InChI=1S/C41H56O5/c1-29(17-13-19-31(3)37(44)24-38(45)41(9)26-34(43)25-40(41,7)8)15-11-12-16-30(2)18-14-20-33(28-42)21-22-36-32(4)23-35(46-10)27-39(36,5)6/h11-20,24,34-35,42-44H,23,25-28H2,1-10H3/b12-11+,17-13+,18-14+,29-15+,30-16+,31-19+,33-20-,37-24- > C1(C)(CC(O)CC1(C)C)C(=O)/C=C(\O)/C(/C)=C/C=C/C(/C)=C/C=C/C=C(\C)/C=C/C=C(\CO)/C#CC1C(C)(C)CC(OC)CC=1C > - > - > - > - > - > - > 23425011 > - > - > - > - > - > 2723817 > - $$$$