LMFA07050192 LIPID_MAPS_STRUCTURE_DATABASE 56 58 0 0 0 999 V2000 16.4706 -12.5815 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.3407 -12.0769 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.1379 -12.5753 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.0612 -12.1765 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.8682 -12.5830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.7188 -12.1117 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.4727 -13.5873 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.3386 -11.0711 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.9879 -7.1893 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.1797 -6.6021 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 21.6791 -8.1394 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.3715 -7.1893 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.6803 -8.1394 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.2664 -8.9476 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.8194 -12.0826 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7189 -12.5821 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9543 -12.5821 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.0892 -12.0826 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2241 -12.5821 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.9886 -10.5840 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0892 -11.0836 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9886 -9.5851 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.2584 -9.5851 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.1235 -9.0854 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8539 -8.0864 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4892 -6.7218 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9886 -7.5869 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4882 -6.7218 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1235 -8.0864 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2583 -7.5869 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.7189 -7.5869 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.7170 -7.5869 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.7148 -7.5869 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.7180 -6.5880 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.7180 -8.5860 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.7158 -6.5880 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.7158 -8.5860 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.7180 -7.5869 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 17.7158 -7.5869 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 19.4215 -6.8807 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.0930 -8.9476 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 19.0938 -9.9466 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 21.0921 -9.9466 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 20.0930 -9.9466 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 20.0930 -10.9457 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 22.9381 -6.8807 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 23.6806 -7.5491 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.3445 -5.9680 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 24.5457 -7.0495 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.6806 -8.5480 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 24.3379 -6.0724 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 25.4108 -7.5490 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 24.5457 -9.0474 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 25.4108 -8.5480 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 26.2760 -7.0495 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 15.5842 -12.0826 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2 1 1 0 0 0 0 3 2 1 0 0 0 0 4 3 1 0 0 0 0 5 4 1 0 0 0 0 6 5 1 0 0 0 0 7 1 2 0 0 0 0 8 2 1 0 0 0 0 9 46 1 1 0 0 0 10 9 1 0 0 0 0 11 9 1 0 0 0 0 12 10 1 0 0 0 0 13 11 1 0 0 0 0 11 14 1 6 0 0 0 12 40 1 1 0 0 0 13 12 1 0 0 0 0 13 41 1 6 0 0 0 21 18 1 0 0 0 0 18 17 1 0 0 0 0 17 15 1 0 0 0 0 15 16 1 0 0 0 0 16 56 1 0 0 0 0 18 19 2 0 0 0 0 20 22 1 0 0 0 0 24 22 1 0 0 0 0 21 20 1 0 0 0 0 24 23 2 0 0 0 0 24 29 1 0 0 0 0 29 27 1 0 0 0 0 27 25 1 0 0 0 0 25 31 1 0 0 0 0 27 26 1 0 0 0 0 27 28 1 0 0 0 0 29 30 1 6 0 0 0 31 38 1 0 0 0 0 38 32 1 0 0 0 0 32 39 1 0 0 0 0 39 33 1 0 0 0 0 38 34 2 0 0 0 0 38 35 1 0 0 0 0 39 36 2 0 0 0 0 39 37 1 0 0 0 0 40 33 1 0 0 0 0 41 44 1 0 0 0 0 44 42 1 0 0 0 0 44 43 1 0 0 0 0 44 45 2 0 0 0 0 47 46 1 0 0 0 0 48 46 1 0 0 0 0 49 47 2 0 0 0 0 50 47 1 0 0 0 0 51 48 2 0 0 0 0 52 49 1 0 0 0 0 51 49 1 0 0 0 0 53 50 2 0 0 0 0 54 52 2 0 0 0 0 55 52 1 0 0 0 0 54 53 1 0 0 0 0 1 56 1 0 0 0 0 M END > LMFA07050192 > 2-Methylhexanoyl-CoA > {[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-4-hydroxy-2-({[hydroxy({[hydroxy(3-hydroxy-2,2-dimethyl-3-{[2-({2-[(2-methylhexanoyl)sulfanyl]ethyl}carbamoyl)ethyl]carbamoyl}propoxy)phosphoryl]oxy})phosphoryl]oxy}methyl)oxolan-3-yl]oxy}phosphonic acid > C28H48N7O17P3S > 879.20 > Fatty Acyls [FA] > Fatty esters [FA07] > Fatty acyl CoAs [FA0705] > - > > - > HMDB0011660 > - > 90224 > - > - > - > - > - > 53481016 > - > - > Active > - > https://lipidmaps.org/databases/lmsd/LMFA07050192 $$$$