LMPR01070482 LIPID_MAPS_STRUCTURE_DATABASE 45 44 0 0 0 999 V2000 14.3099 -4.9848 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3092 -4.9843 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8084 -5.8506 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8077 -5.8501 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3068 -6.7165 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3060 -6.7160 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8052 -7.5824 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8044 -7.5819 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3035 -8.4484 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3028 -8.4478 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8019 -9.3142 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8011 -9.3136 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3004 -10.1801 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2996 -10.1796 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8074 -7.5886 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8091 -11.0279 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7910 -9.2980 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2989 -10.1796 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8023 -9.2977 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8018 -5.8418 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8179 -4.1325 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.8186 -5.8663 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.8120 -5.8542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.3127 -6.7206 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.3134 -6.7204 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.8142 -7.5869 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.8149 -7.5865 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.3155 -8.4531 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.3163 -8.4527 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.8169 -9.3193 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.8177 -9.3190 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.3183 -10.1854 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.3191 -10.1852 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.8198 -11.0517 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 24.8206 -11.0513 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 25.3212 -11.9178 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 26.3220 -11.9176 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 26.8226 -12.7840 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.8201 -5.8423 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.8146 -7.5890 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.8093 -9.3361 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 26.8253 -11.0451 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 27.3227 -11.9176 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 27.8211 -11.0450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3183 -3.2658 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 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 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 10 15 1 0 0 0 0 14 16 1 0 0 0 0 14 17 1 0 0 0 0 14 18 1 0 0 0 0 17 19 1 0 0 0 0 6 20 1 0 0 0 0 2 21 1 0 0 0 0 1 22 1 0 0 0 0 22 23 2 0 0 0 0 23 24 1 0 0 0 0 24 25 2 0 0 0 0 25 26 1 0 0 0 0 26 27 2 0 0 0 0 27 28 1 0 0 0 0 28 29 2 0 0 0 0 29 30 1 0 0 0 0 30 31 2 0 0 0 0 31 32 1 0 0 0 0 32 33 2 0 0 0 0 33 34 1 0 0 0 0 34 35 1 0 0 0 0 35 36 1 0 0 0 0 36 37 1 0 0 0 0 37 38 1 0 0 0 0 25 39 1 0 0 0 0 29 40 1 0 0 0 0 33 41 1 0 0 0 0 37 42 1 0 0 0 0 37 43 1 0 0 0 0 42 44 1 0 0 0 0 21 45 2 0 0 0 0 M END > LMPR01070482 > P 500 > (13Z)-1,1'-Dimethoxy-1,2,1',2'-tetrahydro-psi,psi-caroten-20-al > C42H62O3 > 614.47 > Prenol Lipids [PR] > Isoprenoids [PR01] > C40 isoprenoids (tetraterpenes) [PR0107] > - > > PNTYNLHQUBJAGK-NWXDQPGOSA-N > InChI=1S/C42H62O3/c1-35(21-14-22-36(2)23-15-25-38(4)28-18-32-41(6,7)44-10)20-12-13-30-40(34-43)31-17-27-37(3)24-16-26-39(5)29-19-33-42(8,9)45-11/h12-17,20-27,30-31,34H,18-19,28-29,32-33H2,1-11H3/b13-12+,21-14+,23-15+,24-16+,31-17+,35-20+,36-22+,37-27+,38-25+,39-26+,40-30+ > C(/C=C/C=C(\C)/C=C/C=C(\C)/C=C/C=C(\C)/CCCC(C)(OC)C)=C(\C=O)/C=C/C=C(\C)/C=C/C=C(\C)/CCCC(C)(OC)C > - > - > - > - > - > - > 171120912 > - > - > - > - > - > 61595 > - $$$$