LMPR01070078 LIPID_MAPS_STRUCTURE_DATABASE 45 46 0 0 0 999 V2000 9.3243 7.8595 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7810 8.8471 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6531 9.3515 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5251 8.8471 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.3972 9.3515 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.2692 8.8471 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.1413 9.3515 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.0133 8.8471 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.8856 9.3515 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.7576 8.8471 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.6296 9.3515 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.5017 8.8471 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.3737 9.3515 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.2458 8.8471 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 25.8235 9.3795 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9090 10.3602 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.3972 10.3602 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.7576 7.8385 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.2458 7.8385 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4592 8.3569 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5943 7.8595 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5943 6.8614 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4592 6.3606 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3243 6.8614 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 26.7025 8.9136 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 27.5430 9.4391 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 27.5116 10.4301 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 26.6360 10.8959 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 25.7920 10.3707 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5977 8.8541 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 27.5852 8.4444 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3208 8.8541 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 25.8619 8.3884 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7326 6.3640 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.1858 6.3640 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 24.9478 9.8418 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.0474 8.8541 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9090 9.3515 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1858 7.3586 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 24.1074 9.3445 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 24.9688 8.8471 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 28.3416 10.9801 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 24.9128 10.8399 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 24.1074 10.3391 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.0905 8.3227 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 5 17 1 0 0 0 0 10 18 1 0 0 0 0 14 19 1 0 0 0 0 20 1 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 24 1 1 0 0 0 0 25 15 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 28 29 2 0 0 0 0 15 29 1 0 0 0 0 20 30 1 0 0 0 0 25 31 1 0 0 0 0 20 32 1 0 0 0 0 25 33 1 0 0 0 0 22 34 1 1 0 0 0 24 35 1 1 0 0 0 15 36 1 6 0 0 0 37 38 1 1 0 0 0 16 38 1 0 0 0 0 2 38 2 0 0 0 0 24 39 1 6 0 0 0 14 40 1 0 0 0 0 40 41 1 0 0 0 0 15 41 1 1 0 0 0 27 42 2 0 0 0 0 29 43 1 0 0 0 0 40 44 2 0 0 0 0 1 45 2 0 0 0 0 45 37 2 0 0 0 0 M END > LMPR01070078 > Amarouciaxanthin A > (3S,5R,6R,6'S)-3,5,6'-Trihydroxy-6,7-didehydro-5,6,7',8'-tetrahydro-beta,epsilon-carotene-3',8'-dione > C40H54O5 > 614.40 > Prenol Lipids [PR] > Isoprenoids [PR01] > C40 isoprenoids (tetraterpenes) [PR0107] > - > > NBAOGGCOLYTLDU-VCQLRNSESA-N > InChI=1S/C40H54O5/c1-28(17-13-18-30(3)21-22-36-37(6,7)24-34(42)26-39(36,10)44)15-11-12-16-29(2)19-14-20-31(4)35(43)27-40(45)32(5)23-33(41)25-38(40,8)9/h11-21,23,34,42,44-45H,24-27H2,1-10H3/b12-11+,17-13+,19-14+,28-15+,29-16+,30-18+,31-20+/t22-,34-,39+,40+/m0/s1 > C1(=[C@]=C/C(=C/C=C/C(/C)=C/C=C/C=C(\C)/C=C/C=C(/C(=O)C[C@@]2(O)C(C)=CC(=O)CC2(C)C)\C)/C)[C@@](O)(C)C[C@@H](O)CC1(C)C > - > - > - > - > - > - > 16061220 > VCA0076 > - > - > - > - > 322837 > 3840198 $$$$