LMPR01080057 LIPID_MAPS_STRUCTURE_DATABASE 64 64 0 0 0 999 V2000 -3.0309 -0.2487 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1698 -0.7458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8986 -0.7458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7665 -0.2487 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6345 -0.7458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5024 -0.2487 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3704 -0.7458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2383 -0.2487 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1063 -0.7458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9742 -0.2487 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.8422 -0.7458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.7101 -0.2487 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.5781 -0.7458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.4460 -0.2487 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.3140 -0.7458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.1819 -0.2487 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.0499 -0.7458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.9178 -0.2487 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -17.7858 -0.7458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -18.6537 -0.2487 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -19.5217 -0.7458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -20.3896 -0.2487 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -21.2575 -0.7458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -22.1255 -0.2487 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -22.9935 -0.7458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -23.8614 -0.2487 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -24.7293 -0.7458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -25.5973 -0.2487 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -26.4652 -0.7458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -27.3332 -0.2487 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -28.2011 -0.7458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -29.0691 -0.2487 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -29.9370 -0.7458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -30.8050 -0.2487 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -31.6729 -0.7458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -32.5409 -0.2487 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7665 0.7512 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2383 0.7512 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.7101 0.7512 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.1819 0.7512 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.4748 0.4584 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -18.6537 0.7512 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -17.7878 0.2513 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -21.8667 0.7171 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -22.6254 0.6172 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -24.7313 0.2513 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -25.8560 0.7171 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -28.5691 0.6172 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -29.5690 0.6172 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -31.6729 -1.7457 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -33.4051 -0.7516 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -32.5444 0.7512 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -33.4068 0.2513 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4297 -1.7341 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2966 -0.7210 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2800 1.2757 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3136 0.7616 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4795 2.6077 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3080 -0.2417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4381 -0.7357 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4267 -0.2268 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4182 0.7715 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4518 1.2656 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4602 2.2640 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2 1 1 0 0 0 0 1 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 1 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 1 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 14 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 19 20 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 25 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 1 0 0 0 0 29 30 1 0 0 0 0 30 31 1 0 0 0 0 31 32 1 0 0 0 0 32 33 1 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 4 37 1 0 0 0 8 38 1 0 0 0 12 39 1 0 0 0 16 40 1 0 0 0 16 41 1 0 0 0 20 42 1 0 0 0 20 43 1 0 0 0 24 44 1 0 0 0 24 45 1 0 0 0 28 46 1 0 0 0 28 47 1 0 0 0 32 48 1 0 0 0 32 49 1 0 0 0 35 50 1 0 0 0 36 51 1 0 0 0 36 52 1 0 0 0 36 53 1 0 0 0 58 64 1 0 0 0 63 57 1 0 0 0 57 59 1 0 0 0 59 60 1 0 0 0 60 61 1 0 0 0 61 62 1 0 0 0 62 63 1 0 0 0 63 64 1 6 0 0 59 2 1 6 0 0 60 54 1 6 0 0 61 55 1 6 0 0 62 56 1 1 0 0 M END > LMPR01080057 > neodidymelliol A > 3,7,11,15,19,23,27,31,35-nonamethylhexatriaconta-2E,6E-diene-1,15,19,23,27,31,34,35-octol > C51H98O13 > 918.70 > Prenol Lipids [PR] > Isoprenoids [PR01] > Polyterpenes [PR0108] > - > > QEARTYFPCHUZCM-CHPIFKKYSA-N > InChI=1S/C51H98O13/c1-37(19-12-21-39(3)24-35-63-45-44(56)43(55)42(54)40(36-52)64-45)18-11-20-38(2)22-13-25-47(6,58)26-14-27-48(7,59)28-15-29-49(8,60)30-16-31-50(9,61)32-17-33-51(10,62)34-23-41(53)46(4,5)57/h19,24,38,40-45,52-62H,11-18,20-23,25-36H2,1-10H3/b37-19+,39-24+/t38?,40-,41?,42-,43+,44+,45-,47?,48?,49?,50?,51?/m1/s1 > C(/C=C(\C)/CC/C=C(\C)/CCCC(C)CCCC(O)(C)CCCC(O)(C)CCCC(C)(O)CCCC(C)(O)CCCC(C)(O)CCC(O)C(O)(C)C)O[C@H]1[C@@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O1 > - > - > - > - > - > - > - > - > - > - > - > - > 2233985 > 38351796 $$$$