LMST01010566 LIPID_MAPS_STRUCTURE_DATABASE 46 50 0 0 0 999 V2000 6.8760 7.1304 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8632 5.4044 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8615 5.4187 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8775 7.1563 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3809 8.0079 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8776 7.1362 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3712 6.2733 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3679 6.2817 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8760 7.1505 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3824 8.0135 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3245 13.0173 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.1829 12.5417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.5979 11.0311 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.7135 11.5417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.7135 10.5226 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.5960 12.0514 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0657 12.0514 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3004 12.0514 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1829 11.5417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.8307 12.0514 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9483 11.5417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1829 10.5226 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7792 10.7426 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2081 8.1611 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.2081 9.1802 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2124 11.2307 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2124 10.2117 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7787 9.6956 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1762 8.8736 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4872 6.9445 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3932 8.1402 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7737 7.6398 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7737 8.6581 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6410 7.1304 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3932 6.1898 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.5127 9.6895 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6410 9.1588 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5214 7.6398 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2862 10.7209 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4104 7.1348 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3932 10.2030 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5214 8.6581 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2733 7.6958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4017 9.1717 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2905 8.6666 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9077 9.1582 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10 5 1 0 0 0 5 6 1 0 0 0 6 7 1 0 0 0 7 8 1 0 0 0 8 9 1 0 0 0 9 10 1 0 0 0 6 1 1 1 0 0 7 2 1 6 0 0 8 3 1 1 0 0 9 4 1 6 0 0 32 1 1 1 0 0 0 33 46 1 1 0 0 17 11 1 6 0 0 19 12 1 1 0 0 14 13 1 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 19 18 1 6 0 0 0 20 14 1 0 0 0 0 21 20 1 0 0 0 0 17 21 1 0 0 0 0 19 17 1 0 0 0 0 22 19 1 0 0 0 0 22 23 1 6 0 0 0 25 24 1 6 0 0 0 27 26 1 1 0 0 0 29 28 1 0 0 0 0 22 28 1 0 0 0 0 25 29 1 0 0 0 0 27 25 1 0 0 0 0 22 27 1 0 0 0 0 33 32 1 0 0 0 0 34 32 1 0 0 0 0 37 33 1 0 0 0 0 38 30 1 1 0 0 0 38 34 1 0 0 0 0 40 38 1 0 0 0 0 40 35 2 0 0 0 0 41 39 1 0 0 0 0 42 36 1 1 0 0 0 42 37 1 0 0 0 0 42 38 1 0 0 0 0 27 39 1 0 0 0 0 43 40 1 0 0 0 0 44 31 1 6 0 0 0 44 41 1 0 0 0 0 44 42 1 0 0 0 0 45 43 2 0 0 0 0 45 44 1 0 0 0 0 45 25 1 0 0 0 0 M END > LMST01010566 > Limnantheoside A > 3-O-(beta-D-Xylopyranosyl)-2beta,3beta,14alpha,20R,22R,25-hexahydroxy-5beta-cholest-7-en-6-one > C32H52O11 > 612.35 > Sterol Lipids [ST] > Sterols [ST01] > Cholesterol and derivatives [ST0101] > - > 20-hydroxyecdysone-3-beta-d-xylopyranoside > TWFDWCNWDDFMIA-FTKCGTHVSA-N > InChI=1S/C32H52O11/c1-28(2,39)9-8-24(36)31(5,40)23-7-11-32(41)17-12-19(33)18-13-22(43-27-26(38)25(37)21(35)15-42-27)20(34)14-29(18,3)16(17)6-10-30(23,32)4/h12,16,18,20-27,34-41H,6-11,13-15H2,1-5H3/t16-,18-,20-,21+,22+,23-,24+,25-,26+,27-,29+,30+,31+,32+/m0/s1 > O([C@@H]1C[C@@]2([C@@]([C@@]3(C([C@]4([C@](CC3)([C@@](CC4)([H])[C@@]([C@@H](CCC(C)(C)O)O)(C)O)C)O)=CC2=O)[H])(C[C@@H]1O)C)[H])[C@H]1[C@H](O)[C@@H](O)[C@H](O)CO1 > - > - > - > - > - > - > 102064900 > - > - > - > - > - > 28973 > - $$$$