LMST01010614 LIPID_MAPS_STRUCTURE_DATABASE 43 46 0 0 0 999 V2000 11.0537 8.7849 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1835 9.2791 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0368 7.8345 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3218 8.7766 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1751 10.2888 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1919 7.2854 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0494 10.7957 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3218 7.7796 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4600 9.2666 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3133 9.7861 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1751 6.3603 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4600 7.2812 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6110 8.7766 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6110 7.7796 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7364 9.2833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7322 7.2812 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.1751 8.2696 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3133 6.7741 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8994 8.9875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4892 9.7922 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9560 10.2972 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9560 11.2950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9517 9.2876 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9517 8.2900 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.7646 11.2420 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9060 10.6017 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6341 11.5994 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.4981 12.0982 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9060 11.5994 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0421 12.0982 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7700 12.0982 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2262 12.0982 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.3621 10.6017 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.3621 11.5994 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2262 11.1005 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.9060 12.5993 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.7700 13.0982 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7379 10.2833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8726 10.7846 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6047 10.7820 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6360 13.5982 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6360 14.5982 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5020 13.0982 0.0000 O 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 34 1 0 0 0 0 29 30 1 6 0 0 0 34 32 1 0 0 0 0 34 33 1 0 0 0 0 34 35 1 0 0 0 0 29 36 1 0 0 0 31 37 1 6 0 0 15 38 1 0 0 0 38 39 2 0 0 0 38 40 1 0 0 0 37 41 1 0 0 0 41 42 1 0 0 0 41 43 2 0 0 0 M END > LMST01010614 > 20-hydroxyecdysone 2,22-diacetate > 2beta, 22-diacetoxy-3beta,14alpha,20,25-tetrahydroxy-5beta-cholest-7-en-6-one > C31H48O9 > 564.33 > Sterol Lipids [ST] > Sterols [ST01] > Cholesterol and derivatives [ST0101] > - > > HQRLMIKTLOTLSQ-ZEUSBXCESA-N > InChI=1S/C31H48O9/c1-17(32)39-24-16-28(5)19-8-12-29(6)25(30(7,37)26(40-18(2)33)10-11-27(3,4)36)9-13-31(29,38)20(19)14-22(34)21(28)15-23(24)35/h14,19,21,23-26,35-38H,8-13,15-16H2,1-7H3/t19-,21-,23+,24-,25-,26+,28+,29+,30+,31+/m0/s1 > C12=CC([C@]3([H])C[C@@H](O)[C@@H](OC(C)=O)C[C@]3(C)[C@@]1([H])CC[C@@]1(C)[C@@]2(O)CC[C@@]1([C@](O)(C)[C@H](OC(=O)C)CCC(O)(C)C)[H])=O > - > - > - > ST 31:4;O9 > - > - > 101642417 > - > - > - > - > - > 65004 > 17226485 $$$$