LMST01010389 LIPID_MAPS_STRUCTURE_DATABASE 46 49 0 0 0 0 0 0 0 0999 V2000 13.7896 9.2799 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9074 8.7707 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9074 7.7520 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7896 7.2428 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2990 6.3606 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2804 6.3606 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5539 7.2428 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.4361 7.7520 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.4361 8.7707 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.3180 9.2799 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2973 8.4452 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.3180 10.2986 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.3736 11.1079 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.4361 10.8078 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5539 10.2986 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5539 9.2799 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6717 8.7707 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6717 9.7892 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.4361 11.8265 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.0254 7.2428 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.0254 9.2799 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.1433 8.7707 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2611 9.2799 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3789 8.7707 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4969 9.2799 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6148 8.7707 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6148 7.7520 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7326 9.2799 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.8697 7.8885 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8883 7.8885 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.1433 7.7520 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.2868 8.9651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.8855 9.7892 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.2868 10.6132 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.5374 11.4170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.8498 12.0791 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.3268 11.9008 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.1161 11.2642 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.9820 11.8753 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.9242 11.1623 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.8987 10.2456 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.8409 11.6462 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.7644 10.7295 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 20.9820 12.6648 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.6717 7.7520 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6717 6.7335 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 45 1 0 0 0 0 45 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 6 0 0 0 10 12 1 0 0 0 0 12 13 1 1 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 9 16 2 0 0 0 0 16 17 1 0 0 0 0 1 17 1 0 0 0 0 45 17 1 0 0 0 0 17 18 1 1 0 0 0 14 19 1 6 0 0 0 3 20 1 1 0 0 0 2 21 1 6 0 0 0 21 22 1 0 0 0 0 22 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 27 2 0 0 0 0 26 28 1 0 0 0 0 24 29 1 6 0 0 0 24 30 1 1 0 0 0 22 31 2 0 0 0 0 10 32 1 0 0 0 0 32 33 1 0 0 0 0 33 34 1 0 0 0 0 34 12 1 0 0 0 0 34 35 1 1 0 0 0 35 36 1 6 0 0 0 35 37 1 0 0 0 0 37 38 1 0 0 0 0 38 39 1 0 0 0 0 39 40 1 0 0 0 0 40 41 1 0 0 0 0 40 42 1 0 0 0 0 40 43 1 0 0 0 0 39 44 1 1 0 0 0 45 46 1 6 0 0 0 M END > LMST01010389 > Fasciculic acid B > Lanost-8-ene-2alpha,3beta,12alpha,24R,25-pentol, 2-(3S-hydroxy-3-methylpentanedioate) > C36H60O9 > 636.42 > Sterol Lipids [ST] > Sterols [ST01] > Cholesterol and derivatives [ST0101] > - > > SWRXIGFQDQTNKP-WEYFBGBOSA-N > InChI=1S/C36H60O9/c1-20(10-13-26(37)32(4,5)43)21-14-15-35(8)22-11-12-25-31(2,3)30(42)24(45-29(41)19-33(6,44)18-28(39)40)17-34(25,7)23(22)16-27(38)36(21,35)9/h20-21,24-27,30,37-38,42-44H,10-19H2,1-9H3,(H,39,40)/t20-,21-,24-,25+,26-,27+,30+,33+,34-,35+,36+/m1/s1 > C1[C@@]2(C)[C@@]([H])(CCC3=C2C[C@H](O)[C@@]2([C@@H]([C@@H](CC[C@@H](O)C(O)(C)C)C)CC[C@@]32C)C)C(C)(C)[C@@H](O)[C@@H]1OC(=O)C[C@](O)(C)CC(O)=O > - > HMDB36438 > - > - > - > - > 73242211 > - > Prenol Lipids [PR] > Isoprenoids [PR01] > C30 isoprenoids (triterpenes) [PR0106] > Lanostane triterpenoids [PR010605] > 72129 > - $$$$