LMST01010439 LIPID_MAPS_STRUCTURE_DATABASE 53 56 0 0 0 999 V2000 11.0543 8.7854 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1840 9.2796 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0374 7.8349 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3223 8.7771 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1756 10.2894 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1924 7.2858 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0500 10.7963 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3223 7.7800 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4605 9.2671 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3138 9.7866 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1756 6.3606 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4605 7.2816 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6114 8.7771 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6114 7.7800 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7368 9.2838 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7326 7.2816 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.1756 8.2700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3138 6.7745 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9001 8.9880 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4899 9.7927 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9566 10.2978 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9566 11.2956 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9523 9.2881 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9523 8.2904 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.7653 11.2426 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9067 10.6023 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6349 11.6000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.4989 12.0989 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9067 11.6000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0427 12.0989 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7707 12.0989 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7707 13.0966 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.2271 12.0989 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.3630 10.6023 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.3630 11.6000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2271 11.1011 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.5467 13.5176 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5467 14.3439 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.2615 13.1060 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.9765 13.5176 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.6914 13.1060 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.4062 13.5176 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.1213 13.1060 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.8360 13.5176 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.5510 13.1060 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.2661 13.5176 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.9809 13.1060 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.6959 13.5176 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.4106 13.1060 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.1249 13.5187 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.8394 13.1060 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 24.5538 13.5187 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 25.2681 13.1060 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 23 1 0 0 0 0 1 2 1 0 0 0 0 1 3 2 0 0 0 0 2 4 1 0 0 0 0 2 5 1 0 0 0 0 2 17 1 6 0 0 0 3 6 1 0 0 0 0 21 7 1 0 0 0 0 4 8 1 0 0 0 0 4 9 1 0 0 0 0 4 10 1 1 0 0 0 5 7 1 0 0 0 0 6 11 2 0 0 0 0 6 8 1 0 0 0 0 8 12 1 0 0 0 0 8 18 1 1 0 0 0 9 13 1 0 0 0 0 12 14 1 0 0 0 0 13 15 1 1 0 0 0 13 14 1 0 0 0 0 14 16 1 1 0 0 0 26 21 1 0 0 0 0 21 23 1 0 0 0 0 23 19 1 0 0 0 0 26 20 1 0 0 0 0 19 20 1 0 0 0 0 21 22 1 1 0 0 0 23 24 1 6 0 0 0 26 25 1 6 0 0 0 26 29 1 0 0 0 0 29 31 1 0 0 0 0 31 27 1 0 0 0 0 27 28 1 0 0 0 0 28 35 1 0 0 0 0 29 30 1 6 0 0 0 31 32 1 6 0 0 0 35 33 1 0 0 0 0 35 34 1 0 0 0 0 35 36 1 0 0 0 0 37 38 2 0 0 0 0 37 39 1 0 0 0 0 39 40 1 0 0 0 0 40 41 1 0 0 0 0 41 42 1 0 0 0 0 42 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 1 0 0 0 0 50 51 1 0 0 0 0 51 52 1 0 0 0 0 52 53 1 0 0 0 0 32 37 1 0 0 0 0 M END > LMST01010439 > Ecdysone 22-palmitate > 22-O-hexadecanoyl-2beta,3beta,14alpha,22R,25-pentahydroxy-5beta-cholest-7-en-6-one > C43H74O7 > 702.54 > Sterol Lipids [ST] > Sterols [ST01] > Cholesterol and derivatives [ST0101] > - > > SEAXTSQHMHXGKM-XVKLGRHKSA-N > InChI=1S/C43H74O7/c1-7-8-9-10-11-12-13-14-15-16-17-18-19-20-39(47)50-38(23-24-40(3,4)48)30(2)31-22-26-43(49)33-27-35(44)34-28-36(45)37(46)29-41(34,5)32(33)21-25-42(31,43)6/h27,30-32,34,36-38,45-46,48-49H,7-26,28-29H2,1-6H3/t30-,31+,32-,34-,36+,37-,38+,41+,42+,43+/m0/s1 > C12=CC([C@]3([H])C[C@@H](O)[C@@H](O)C[C@]3(C)[C@@]1([H])CC[C@@]1(C)[C@@]2(O)CC[C@@]1([C@H](C)[C@H](OC(CCCCCCCCCCCCCCC)=O)CCC(O)(C)C)[H])=O > - > - > - > - > - > - > 15920449 > - > - > - > - > - > 6941 > 3030275 $$$$