LMPR01070439 LIPID_MAPS_STRUCTURE_DATABASE 43 43 0 0 0 999 V2000 -8.9279 2.4834 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7338 1.8980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.4259 0.9508 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4300 0.9508 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1223 1.8980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2597 2.3960 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3973 1.8980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5347 2.3960 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6722 1.8980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8097 2.3960 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9472 1.8980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0846 2.3960 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2221 1.8980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3596 2.3960 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5029 1.8980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3655 2.3960 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2279 1.8980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0905 2.3960 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9530 1.8980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2238 3.4177 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.4259 3.3459 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.8446 0.1451 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3426 -0.7174 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8486 0.1451 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3466 -0.7174 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.5347 3.3919 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0846 3.3919 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8156 2.3960 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6780 1.8980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5406 2.3960 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4031 1.8980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2655 2.3960 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1281 1.8980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9907 2.3960 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8532 1.8980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7156 2.3960 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5782 1.8980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4408 2.3960 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2279 0.9020 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6780 0.9020 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1281 0.9020 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5782 0.9020 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8486 -1.5800 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 5 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 6 7 2 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 5 6 1 6 0 0 0 1 20 1 1 0 0 0 1 21 1 6 0 0 0 4 22 1 1 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 25 1 0 0 0 0 8 26 1 0 0 0 0 12 27 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 2 0 0 0 0 37 38 1 0 0 0 0 19 28 1 0 0 0 0 17 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 25 43 1 0 0 0 0 M END > LMPR01070439 > (2S,5S,6R)-2,6-cyclolycopene-1-methoxy-5-ol > (2S,5S,6R)-1,2,5,6-Tetrahydro-2,6-cyclo-1-methoxy-psi,psi-carotene-5-ol > C41H60O2 > 584.46 > Prenol Lipids [PR] > Isoprenoids [PR01] > C40 isoprenoids (tetraterpenes) [PR0107] > - > > RRKGUCMFKYLBQP-WTGRNGLDSA-N > InChI=1S/C41H60O2/c1-32(2)18-14-21-35(5)24-16-26-36(6)25-15-22-33(3)19-12-13-20-34(4)23-17-27-37(7)28-29-39-38(40(8,9)43-11)30-31-41(39,10)42/h12-13,15-20,22-29,38-39,42H,14,21,30-31H2,1-11H3/b13-12+,22-15+,23-17+,26-16+,29-28+,33-19+,34-20+,35-24+,36-25+,37-27+/t38-,39+,41-/m0/s1 > [C@@]1(O)(C)[C@H](/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)/CC/C=C(\C)/C)[C@@H](C(OC)(C)C)CC1 > - > - > - > - > - > - > 12986463 > - > - > - > - > - > 4081 > 14730145 $$$$