LMST01120011 LIPID_MAPS_STRUCTURE_DATABASE 64 71 0 0 0 999 V2000 16.2589 15.3607 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.3928 14.8607 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.2589 13.3607 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.9909 13.3607 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.8570 13.8607 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.8570 16.8607 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.9909 16.3607 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.6741 15.0518 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.2618 15.8607 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.1250 14.8607 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.1250 15.8607 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.7230 16.3607 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.7230 17.3607 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.8570 14.8607 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.8570 15.8607 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.1250 13.8607 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.1250 12.8607 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.7230 15.3607 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.7230 14.3607 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.9909 15.3607 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.9909 14.3607 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.6741 17.6697 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.4830 18.2576 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.8651 18.2576 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.6741 16.6697 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.3811 17.3768 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.1741 19.2085 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 21.1741 19.2085 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.8811 19.9156 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.3928 13.8607 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5269 13.3607 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.5872 13.0187 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8212 13.6615 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.4135 12.0340 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1796 11.3912 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.7078 12.3347 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4738 11.6920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3002 10.7071 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.3605 10.3651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8815 13.3195 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1154 13.9623 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7681 11.9926 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.0021 12.6355 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1757 13.6203 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0623 12.2934 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8886 11.3086 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4699 13.9210 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7038 14.5638 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2962 12.9362 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3565 12.5942 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.4097 14.2630 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5833 15.2479 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8173 15.8907 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9909 16.8755 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9306 17.2175 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3985 18.5031 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6325 19.1459 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.1043 18.2023 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0440 18.5443 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2176 19.5291 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2248 17.5182 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2851 17.1762 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.3382 18.8451 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5119 19.8299 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 10 1 0 0 0 0 2 30 1 0 0 0 0 30 3 1 0 0 0 0 3 16 1 0 0 0 0 20 10 1 0 0 0 0 10 16 1 0 0 0 0 16 4 1 0 0 0 0 4 5 1 0 0 0 0 5 14 1 0 0 0 0 14 18 1 0 0 0 0 20 14 1 0 0 0 0 7 20 1 0 0 0 0 6 7 1 0 0 0 0 6 12 1 0 0 0 0 18 8 1 0 0 0 0 12 18 1 0 0 0 0 25 12 1 0 0 0 0 25 9 1 0 0 0 0 8 9 1 0 0 0 0 10 11 1 1 0 0 0 12 13 1 1 0 0 0 14 15 1 1 0 0 0 16 17 1 1 0 0 0 18 19 1 1 0 0 0 20 21 1 6 0 0 0 25 22 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 23 28 1 0 0 0 0 28 27 1 0 0 0 0 27 24 1 0 0 0 0 25 26 1 6 0 0 0 28 29 2 0 0 0 0 30 31 1 1 0 0 0 32 31 1 1 0 0 0 32 33 1 0 0 0 0 32 34 1 0 0 0 0 33 40 1 0 0 0 0 40 36 1 0 0 0 0 36 37 1 0 0 0 0 37 34 1 0 0 0 0 34 35 1 1 0 0 0 36 42 1 1 0 0 0 37 38 1 6 0 0 0 38 39 1 0 0 0 0 40 41 1 6 0 0 0 43 42 1 1 0 0 0 45 43 1 0 0 0 0 44 43 1 0 0 0 0 44 51 1 0 0 0 0 51 47 1 0 0 0 0 47 49 1 0 0 0 0 49 45 1 0 0 0 0 45 46 1 6 0 0 0 47 48 1 6 0 0 0 49 50 1 1 0 0 0 51 52 1 1 0 0 0 52 53 1 0 0 0 0 54 53 1 1 0 0 0 61 54 1 0 0 0 0 54 55 1 0 0 0 0 58 63 1 0 0 0 0 58 55 1 0 0 0 0 63 56 1 0 0 0 0 56 61 1 0 0 0 0 56 57 1 1 0 0 0 58 59 1 1 0 0 0 59 60 1 0 0 0 0 61 62 1 6 0 0 0 63 64 1 6 0 0 0 M END > LMST01120011 > thevetin B > 3beta-[beta-D-glucopyranosyl-(1-6)-beta-D-glucopyranosyl-(1-4)-6-deoxy-3-O-methyl-alpha-L-glucopyranosyloxy]-14-hydroxy-5beta-card-20(22)-enolide > C42H66O18 > 858.42 > Sterol Lipids [ST] > Sterols [ST01] > Cardanolides and derivatives [ST0112] > - > Thevetin B > C08856 > - > - > 27511 > - > - > - > - > - > 441850 > - > - > Active > - > https://lipidmaps.org/databases/lmsd/LMST01120011 $$$$