LMST01040215 LIPID_MAPS_STRUCTURE_DATABASE 63 67 0 0 0 999 V2000 -3.6437 -3.9241 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8223 -4.3982 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6437 -2.9755 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4712 -4.3982 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2991 -3.9241 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1270 -4.3982 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9549 -3.9241 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7828 -4.3982 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6107 -3.9241 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.4386 -3.9241 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.2665 -4.3982 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.0944 -3.9241 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.9222 -3.9241 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.7501 -4.3982 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.5780 -3.9241 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.4059 -4.3982 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.2338 -3.9241 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -16.0616 -4.3982 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4567 -5.1654 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4567 -6.2248 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3643 -6.7605 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3643 -4.6410 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2837 -6.2248 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2095 -6.7570 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1117 -6.2584 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2837 -5.1654 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1100 -5.1128 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1223 -3.0118 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1925 -3.5537 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2021 -4.6266 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0614 -3.5432 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0575 -4.6170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9293 -4.6073 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9199 -3.5495 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9924 -3.0060 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4534 -6.9113 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2739 -4.2765 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1249 -4.2649 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0537 -2.6646 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1993 -5.4866 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0565 -5.4482 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9969 -2.0130 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5267 -2.4895 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2285 -1.5095 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8446 -1.3772 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8517 -2.0130 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8054 -1.3772 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8120 -2.0130 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8120 -3.0992 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7394 -1.4035 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9758 -1.2147 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8050 -0.4927 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7128 0.0314 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4041 -8.5314 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2827 -8.5180 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2064 -6.8871 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8567 -6.0877 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3905 -6.9060 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8659 -7.7158 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8076 -7.7080 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2692 -6.8925 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7938 -6.0826 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2556 -5.2671 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2 1 1 0 0 0 0 1 3 2 0 0 0 0 1 4 1 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 1 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 2 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 19 22 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 21 23 1 0 0 0 0 26 22 1 0 0 0 0 23 26 1 0 0 0 0 23 24 2 0 0 0 0 24 25 1 0 0 0 0 30 26 1 0 0 0 0 27 30 1 0 0 0 0 27 32 1 0 0 0 0 31 28 1 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 31 32 1 0 0 0 0 33 34 1 0 0 0 0 34 35 1 0 0 0 0 35 31 1 0 0 0 0 32 33 1 0 0 0 0 26 37 1 1 0 0 0 27 38 1 1 0 0 0 31 39 1 1 0 0 0 30 40 1 6 0 0 0 32 41 1 6 0 0 0 27 25 1 0 0 0 0 20 36 1 1 0 0 0 35 42 1 0 0 0 0 35 43 1 6 0 0 0 42 44 1 6 0 0 0 42 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 48 50 1 0 0 0 0 47 52 1 1 0 0 0 42 51 1 1 0 0 0 52 53 1 0 0 0 0 62 57 1 0 0 0 57 58 1 0 0 0 58 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 1 0 0 58 36 1 1 0 0 59 54 1 6 0 0 60 55 1 1 0 0 61 56 1 6 0 0 63 2 1 0 0 0 M END > LMST01040215 > 16:2-Glc-Sitosterol > 3-O-(6'-O-(7Z,10Z-hexadecadienoyl)-beta-D-glucopyranosyl)-stigmast-5-en-3beta-ol > C51H86O7 > 810.64 > Sterol Lipids [ST] > Sterols [ST01] > Stigmasterols and C24-ethyl derivatives [ST0104] > - > > NRBSJCWBJPZAOY-KVSXBNAISA-N > InChI=1S/C51H86O7/c1-8-10-11-12-13-14-15-16-17-18-19-20-21-22-45(52)56-34-44-46(53)47(54)48(55)49(58-44)57-39-29-31-50(6)38(33-39)25-26-40-42-28-27-41(51(42,7)32-30-43(40)50)36(5)23-24-37(9-2)35(3)4/h13-14,16-17,25,35-37,39-44,46-49,53-55H,8-12,15,18-24,26-34H2,1-7H3/b14-13-,17-16-/t36-,37-,39+,40+,41-,42+,43+,44-,46-,47+,48-,49-,50+,51-/m1/s1 > C(CCCCC/C=C\C/C=C\CCCCC)(=O)OC[C@@H]1[C@@H](O)[C@H](O)[C@@H](O)[C@H](O[C@@H]2CC3=CC[C@@]4([H])[C@]5([H])CC[C@]([H])([C@@]([H])(CC[C@@H](CC)C(C)C)C)[C@@]5(C)CC[C@]4([H])[C@@]3(C)CC2)O1 > - > - > - > - > - > - > 178334292 > - > - > - > - > - > - > - $$$$