LMPR01070949 LIPID_MAPS_STRUCTURE_DATABASE 53 54 0 0 0 999 V2000 3.8456 -11.7736 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8456 -12.7756 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7134 -13.2767 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5811 -12.7756 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5811 -11.7736 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7134 -11.2726 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4669 -11.2726 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3347 -11.7736 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2025 -11.2726 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0703 -11.7736 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9382 -11.2726 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8059 -11.7736 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6736 -11.2726 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5414 -11.7736 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4091 -11.2726 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2771 -11.7736 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1448 -11.2726 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.0126 -11.7736 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8804 -11.2726 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.7482 -11.7736 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.6160 -11.2726 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.4838 -11.7736 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2123 -10.4049 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2144 -10.4049 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4623 -13.2845 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.3468 -11.2754 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.2001 -11.7681 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.0511 -11.2768 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.9031 -11.7688 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.7710 -11.2679 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.7710 -10.2659 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.9189 -9.7739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.0512 -10.2749 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.4838 -12.7756 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.0126 -12.7756 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2025 -10.2706 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6736 -10.2707 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.1908 -9.7779 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.4028 -12.6352 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.4034 -12.6352 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9782 -13.2764 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3347 -12.7559 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 24.6591 -9.7531 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0625 -9.7739 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0625 -8.7733 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9548 -8.2584 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2054 -8.2781 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.8024 -8.7539 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6689 -8.2536 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5354 -8.7539 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4019 -8.2536 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2577 -8.7478 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1070 -8.2576 0.0000 C 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 2 0 0 0 5 6 1 0 0 0 1 6 1 0 0 0 5 7 1 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 4 25 1 0 0 0 22 26 1 0 0 0 26 27 2 0 0 0 28 27 1 1 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 32 33 2 0 0 0 28 33 1 0 0 0 22 34 1 0 0 0 18 35 1 0 0 0 9 36 1 0 0 0 13 37 1 0 0 0 33 38 1 0 0 0 29 39 1 0 0 0 29 40 1 0 0 0 2 41 1 1 0 0 8 42 2 0 0 0 31 43 1 6 0 0 36 44 1 0 0 0 44 45 1 0 0 0 45 46 1 0 0 0 45 47 2 0 0 0 46 48 2 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 M END > LMPR01070949 > Siphonaxanthin octenoate > (3R,3'R,6'R)-19-(trans-Oct-2-enoyloxy)-3,3'-dihydroxy-7,8-dihydro-beta,epsilon-caroten-8-one > C48H68O5 > 724.51 > Prenol Lipids [PR] > Isoprenoids [PR01] > C40 isoprenoids (tetraterpenes) [PR0107] > - > > DBTVWXCYDOGLIW-VPSZULFQSA-N > InChI=1S/C48H68O5/c1-11-12-13-14-15-26-46(52)53-34-40(45(51)31-44-39(6)30-42(50)33-48(44,9)10)25-19-24-36(3)21-17-16-20-35(2)22-18-23-37(4)27-28-43-38(5)29-41(49)32-47(43,7)8/h15-29,41-43,49-50H,11-14,30-34H2,1-10H3/b17-16+,22-18+,24-19+,26-15+,28-27+,35-20+,36-21+,37-23+,40-25+/t41-,42+,43-/m0/s1 > C1C(C)(C)C(CC(=O)/C(/COC(=O)/C=C/CCCCC)=C/C=C/C(/C)=C/C=C/C=C(\C)/C=C/C=C(\C)/C=C/[C@H]2C(C)=C[C@H](O)CC2(C)C)=C(C)C[C@H]1O > - > - > - > - > - > - > 163057414 > - > - > - > - > - > 36894 > - $$$$