LMSP0601BK03 LIPID_MAPS_STRUCTURE_DATABASE 132136 0 0 0 999 V2000 31.4949 10.0670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 30.5391 10.6172 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 29.5829 10.0670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 32.0475 9.1110 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 30.9422 9.1110 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 32.4511 10.6189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 29.9410 8.5460 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 29.9410 7.4405 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 28.9851 9.0983 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 31.0595 11.5186 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 30.0061 11.5398 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 28.0221 8.5460 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 27.0586 9.0983 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 26.0951 8.5460 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 25.1315 9.0983 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 24.1682 8.5460 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 28.6190 10.6171 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 27.6554 10.0670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 26.6919 10.6171 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 25.7285 10.0670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 24.7647 10.6171 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.8015 10.0670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.8379 10.6171 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.8743 10.0670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 24.1682 7.3957 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.8743 9.1209 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.8185 8.5113 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.7629 9.1209 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.7072 8.5113 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.6514 9.1209 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.5958 8.5113 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.1217 6.7916 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.0752 7.3957 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.0287 6.7916 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.9821 7.3957 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.9357 6.7916 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.8891 7.3957 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8427 6.7916 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7961 7.3957 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7497 6.7916 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7031 7.3957 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6567 6.7916 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6101 7.3957 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 32.4577 14.9123 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 31.0868 14.1160 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 30.1329 14.1160 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 29.6559 14.9418 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 29.7446 16.4424 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 31.5637 13.2898 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 29.4584 13.4415 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 30.1329 17.1168 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 31.0868 15.7681 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 30.1329 15.7681 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 31.5637 14.9418 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 28.6300 14.9409 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 27.6140 13.2089 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 24.6181 14.9668 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 27.1297 15.8213 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 24.6454 16.5259 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 27.6282 14.9468 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 27.1202 14.0806 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 26.1134 14.0893 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 25.6197 14.9609 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 26.1279 15.8270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 25.6339 16.6986 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 25.3779 13.2529 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 24.1234 13.5113 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.8704 12.5671 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.9264 12.3142 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.2353 13.0052 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.4882 13.9494 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.7976 14.6400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.8542 14.3873 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.1636 15.0776 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 24.4697 14.0441 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 25.2836 14.0957 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 24.1112 14.6195 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 22.6734 11.3702 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 21.2912 12.7524 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 22.0504 15.5834 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 19.8269 13.5809 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 23.4322 14.2023 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 22.7410 14.8927 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 21.0690 11.9231 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.3395 11.7480 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.7345 11.3994 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 20.4105 15.9990 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.1698 14.1727 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0000 13.2101 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0818 12.8757 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3331 13.5042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5027 14.4666 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7545 15.0942 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8368 14.7605 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0884 15.3881 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4686 14.7337 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2750 14.8561 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.0612 15.2756 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.4145 13.1697 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.9242 16.0562 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.4211 14.8009 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6723 15.4283 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2655 12.3243 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5543 12.0866 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2586 16.3521 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.5927 14.0305 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.9118 11.9131 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.9740 11.8601 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.5997 13.8015 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.3467 12.8573 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.4026 12.6044 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.7115 13.2954 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.9644 14.2397 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.2738 14.9302 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.3304 14.6775 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6398 15.3679 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.9460 14.3343 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.7599 14.3859 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.5874 14.9097 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.1496 11.6604 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.7674 13.0426 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 16.5266 15.8736 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.3032 13.8711 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.9085 14.4925 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.2172 15.1829 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5452 12.2133 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.8158 12.0383 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.2107 11.6897 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.8867 16.2893 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4927 16.9950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6666 17.9798 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5530 16.6532 0.0000 O 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 1 5 1 6 0 0 0 1 4 1 1 0 0 0 6 1 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 7 5 1 0 0 0 0 2 10 1 1 0 0 0 2 11 1 6 0 0 0 9 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 3 17 2 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 16 25 1 0 0 0 0 24 26 1 0 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 30 31 1 0 0 0 0 25 32 1 0 0 0 0 32 33 1 0 0 0 0 33 34 1 0 0 0 0 34 35 1 0 0 0 0 35 36 1 0 0 0 0 36 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 41 42 1 0 0 0 0 42 43 1 0 0 0 0 6 44 1 0 0 0 0 46 45 1 0 0 0 47 46 1 0 0 0 45 49 1 6 0 0 46 50 1 1 0 0 48 51 1 0 0 0 53 52 1 0 0 0 47 53 1 0 0 0 53 48 1 1 0 0 54 45 1 0 0 0 54 52 1 0 0 0 59 65 1 0 0 0 64 58 1 0 0 0 58 60 1 0 0 0 60 61 1 0 0 0 61 62 1 0 0 0 62 63 1 0 0 0 63 64 1 0 0 0 64 65 1 1 0 0 60 55 1 1 0 0 61 56 1 6 0 0 63 57 1 1 0 0 75 76 2 0 0 0 75 77 1 0 0 0 67 75 1 1 0 0 68 67 1 0 0 0 68 69 1 0 0 0 67 82 1 0 0 0 69 70 1 0 0 0 70 71 1 0 0 0 71 72 1 0 0 0 71 82 1 0 0 0 72 73 1 0 0 0 73 74 1 0 0 0 69 78 1 6 0 0 70 79 1 1 0 0 72 80 1 1 0 0 73 81 1 6 0 0 71 83 1 1 0 0 79 84 1 0 0 0 84 85 1 0 0 0 84 86 2 0 0 0 67 66 1 6 0 0 74 87 1 0 0 0 62 66 1 1 0 0 96 97 2 0 0 0 96 98 1 0 0 0 88 96 1 1 0 0 89 88 1 0 0 0 89 90 1 0 0 0 88101 1 0 0 0 90 91 1 0 0 0 91 92 1 0 0 0 92 93 1 0 0 0 92101 1 0 0 0 93 94 1 0 0 0 94 95 1 0 0 0 91 99 1 1 0 0 93100 1 1 0 0 92102 1 1 0 0 99103 1 0 0 0 103104 1 0 0 0 95105 1 0 0 0 94106 1 6 0 0 103108 2 0 0 0 90107 1 6 0 0 117118 2 0 0 0 117119 1 0 0 0 109117 1 1 0 0 110109 1 0 0 0 110111 1 0 0 0 109124 1 0 0 0 111112 1 0 0 0 112113 1 0 0 0 113114 1 0 0 0 113124 1 0 0 0 114115 1 0 0 0 115116 1 0 0 0 111120 1 6 0 0 112121 1 1 0 0 114122 1 1 0 0 115123 1 6 0 0 113125 1 1 0 0 121126 1 0 0 0 126127 1 0 0 0 126128 2 0 0 0 116129 1 0 0 0 109 81 1 6 0 0 88123 1 6 0 0 47 55 1 6 0 0 105130 1 0 0 0 130131 1 0 0 0 130132 2 0 0 0 54 44 1 1 0 0 M END > LMSP0601BK03 > > 9-OAc-NeuAcalpha2-8NeuAcalpha2-8NeuAcalpha2-3Galbeta1-4Glcbeta-Cer(d18:1/20:0) > C85H148N4O38 > 1832.98 > Sphingolipids [SP] > Acidic glycosphingolipids [SP06] > Gangliosides [SP0601] > - > > - > - > - > - > - > - > - > - > - > 44262254 > - > - > Active (generated by computational methods) > - > https://lipidmaps.org/databases/lmsd/LMSP0601BK03 $$$$