LMPR01070782 LIPID_MAPS_STRUCTURE_DATABASE 42 43 0 0 0 999 V2000 3.0535 -12.1908 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0535 -13.1914 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9200 -13.6917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7867 -13.1914 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7867 -12.1908 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9200 -11.6905 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6711 -11.6905 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5378 -12.1908 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4043 -11.6905 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2708 -12.1908 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1374 -11.6905 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0039 -12.1908 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8704 -11.6905 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7371 -12.1908 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6035 -11.6905 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4702 -12.1908 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3367 -11.6905 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2033 -12.1908 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.0698 -11.6905 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.9364 -12.1908 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.8029 -11.6905 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.6695 -12.1908 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4197 -10.8240 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4204 -10.8240 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6666 -13.6996 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.5312 -11.6933 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.3833 -12.1853 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.2331 -11.6948 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.0839 -12.1861 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.9506 -11.6858 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.9507 -10.6852 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.0998 -10.1939 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.2331 -10.6942 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.5836 -13.0526 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.5843 -13.0526 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.3509 -10.1846 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.6695 -13.1914 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2033 -13.1914 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4043 -10.6899 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8704 -10.6900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9199 -14.6845 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 22.0998 -9.1831 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 2 0 0 0 5 6 1 0 0 0 1 6 1 0 0 0 5 7 1 0 0 0 7 8 2 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 1 0 0 0 28 33 1 0 0 0 29 34 1 0 0 0 29 35 1 0 0 0 33 36 1 6 0 0 22 37 1 0 0 0 18 38 1 0 0 0 9 39 1 0 0 0 13 40 1 0 0 0 3 41 2 0 0 0 32 42 1 1 0 0 M END > LMPR01070782 > 4'-Hydroxy-5',6'-dihydroechinenone > (4'S,5'S,6'S)-4'-Hydroxy-5',6'-dihydro-beta,beta-caroten-4-one > C40H56O2 > 568.43 > Prenol Lipids [PR] > Isoprenoids [PR01] > C40 isoprenoids (tetraterpenes) [PR0107] > - > > CBMMHDFSRYRFMK-VTLCXHAGSA-N > InChI=1S/C40H56O2/c1-29(17-13-19-31(3)21-23-35-33(5)37(41)25-27-39(35,7)8)15-11-12-16-30(2)18-14-20-32(4)22-24-36-34(6)38(42)26-28-40(36,9)10/h11-24,33,35,37,41H,25-28H2,1-10H3/b12-11+,17-13+,18-14+,23-21+,24-22+,29-15+,30-16+,31-19+,32-20+/t33-,35-,37-/m0/s1 > C1C(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@H]2[C@H](C)[C@@H](O)CCC2(C)C)=C(C)C(=O)C1 > - > - > - > - > - > - > 11082356 > - > - > - > - > - > 6487 > 11575944 $$$$