LMST01020171 LIPID_MAPS_STRUCTURE_DATABASE 61 64 0 0 0 999 V2000 -4.1962 4.8061 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2017 6.7982 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0643 6.2954 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0554 5.2995 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3299 6.3054 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3335 5.3086 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6085 5.3026 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6049 6.2993 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4658 6.8038 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1990 5.7831 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3615 7.3663 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4764 7.7727 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6182 8.2599 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4644 8.7499 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7775 7.7706 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0665 8.2540 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9072 7.7648 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3345 4.3402 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9127 4.8061 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9127 3.8149 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0554 3.3210 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1962 3.8149 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7645 5.2977 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6165 4.8061 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6165 3.8224 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7645 3.3307 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9127 5.7894 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4683 3.3307 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6157 7.1799 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2357 8.2502 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0554 4.3162 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6478 7.3369 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9925 6.7702 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7724 8.2623 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6358 7.7618 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7741 9.2602 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5899 8.8347 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1741 6.1993 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8962 6.3470 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0778 5.7760 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3320 2.8286 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3320 1.8145 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.2166 3.3355 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.1016 2.8286 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.9865 3.3355 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.8715 2.8286 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.7565 3.3355 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.6414 2.8286 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.5264 3.3355 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.4114 3.3355 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -17.2964 2.8286 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -18.1814 3.3355 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -19.0663 3.3355 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -19.9513 2.8286 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -20.8362 3.3355 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -21.7212 3.3355 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -22.6062 2.8286 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -23.4911 3.3355 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -24.3761 2.8286 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -25.2610 3.3355 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -26.1460 2.8286 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 4 1 0 0 0 0 1 6 1 0 0 0 0 5 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 5 6 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 5 1 0 0 0 0 6 7 1 0 0 0 0 1 10 1 1 0 0 0 5 11 1 1 0 0 0 9 12 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 1 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 6 18 1 6 0 0 0 4 19 1 0 0 0 0 19 20 1 0 0 0 0 20 21 2 0 0 0 0 21 22 1 0 0 0 0 22 1 1 0 0 0 0 19 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 20 1 0 0 0 0 19 27 1 1 0 0 0 25 28 1 1 0 0 0 9 29 1 6 0 0 0 12 30 1 6 0 0 0 4 31 1 6 0 0 0 17 32 1 0 0 0 0 17 33 1 0 0 0 17 34 1 0 0 0 34 35 1 0 0 0 34 36 1 0 0 0 34 37 1 0 0 0 33 38 1 0 0 0 33 39 1 0 0 0 33 40 1 0 0 0 41 42 2 0 0 0 0 41 43 1 0 0 0 0 43 44 1 0 0 0 0 44 45 1 0 0 0 0 45 46 1 0 0 0 0 46 47 1 0 0 0 0 47 48 1 0 0 0 0 48 49 1 0 0 0 0 49 50 2 0 0 0 0 50 51 1 0 0 0 0 51 52 1 0 0 0 0 52 53 2 0 0 0 0 53 54 1 0 0 0 0 54 55 1 0 0 0 0 55 56 2 0 0 0 0 56 57 1 0 0 0 0 57 58 1 0 0 0 0 58 59 1 0 0 0 0 59 60 1 0 0 0 0 60 61 1 0 0 0 0 28 41 1 0 0 0 0 M ISO 7 32 2 35 2 36 2 37 2 38 2 39 2 40 2 M END > LMST01020171 > 20:3 Cholesterol(d7) > cholest-5-en-3beta-yl(d7) (8Z,11Z,14Z-eicosatrienoate) > C47H71D7O2 > 681.64 > Sterol Lipids [ST] > Sterols [ST01] > Steryl esters [ST0102] > - > 25,26,26,26,27,27,27-heptadeuteriocholest-5-en-3beta-ol (9Z-hexadecenoate); cholesteryl-d7 eicosa-8Z,11Z,14Z-trienoate > MLPRJPSMAFZPLA-RGISREMOSA-N > InChI=1S/C47H78O2/c1-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-27-45(48)49-40-32-34-46(5)39(36-40)28-29-41-43-31-30-42(38(4)26-24-25-37(2)3)47(43,6)35-33-44(41)46/h11-12,14-15,17-18,28,37-38,40-44H,7-10,13,16,19-27,29-36H2,1-6H3/b12-11-,15-14-,18-17-/t38-,40+,41+,42-,43+,44+,46+,47-/m1/s1/i2D3,3D3,37D > [C@]12(CC=C3C[C@@H](OC(CCCCCC/C=C\C/C=C\C/C=C\CCCCC)=O)CC[C@]3(C)[C@@]1([H])CC[C@]1(C)[C@@]([H])([C@@](C)([H])CCCC(C([2H])([2H])[2H])(C([2H])([2H])[2H])[2H])CC[C@@]21[H])[H] > - > - > - > - > - > - > 178334258 > - > - > - > - > - > 32630 > - $$$$