LMSP0601CL07 LIPID_MAPS_STRUCTURE_DATABASE 159166 0 0 0 999 V2000 30.7497 9.8322 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 29.8174 10.3688 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 28.8850 9.8322 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 31.2886 8.8998 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 30.2107 8.8998 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 31.6822 10.3704 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 29.2341 8.3488 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 29.2341 7.2707 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 28.3019 8.8874 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 30.3249 11.2480 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 29.2977 11.2685 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 27.3628 8.3488 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 26.4230 8.8874 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 25.4834 8.3488 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 24.5436 8.8874 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.6041 8.3488 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 27.9449 10.3687 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 27.0052 9.8322 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 26.0655 10.3687 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 25.1258 9.8322 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 24.1859 10.3687 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.2466 9.8322 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.3067 10.3687 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.3670 9.8322 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.6041 7.2269 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.3670 8.9095 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.3374 8.3150 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.3078 8.9095 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.2782 8.3150 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2485 8.9095 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.2189 8.3150 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.5835 6.6378 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.5629 7.2269 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.5422 6.6378 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.5216 7.2269 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.5010 6.6378 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.4804 7.2269 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.4597 6.6378 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.4391 6.6378 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4185 7.2269 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3978 6.6378 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3772 7.2269 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3567 6.6378 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3361 7.2269 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3155 6.6378 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2948 7.2269 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2742 6.6378 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 31.6887 13.2459 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 27.1533 14.0320 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 26.2350 13.7860 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 25.5629 14.4582 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 25.8089 15.3764 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 26.7271 15.6225 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 26.9288 16.3714 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 25.9889 12.8678 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 24.6121 14.4583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 25.1367 16.0486 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 27.3994 14.9502 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 27.6777 16.5730 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 23.6615 14.4582 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.6615 13.4842 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.8179 12.9971 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.9744 13.4842 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.9744 14.4582 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.1314 14.9449 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.2884 14.4582 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.4456 14.9448 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.8576 15.0605 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 24.6277 15.3201 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 23.3639 15.5220 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 22.8178 12.0230 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 21.1307 12.9971 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 21.1314 15.9182 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 19.5074 13.4170 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 22.8178 14.9452 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 21.9744 15.4315 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 21.1307 12.1415 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.4737 11.7849 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.9065 11.8088 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.5066 13.4356 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.5067 12.4615 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.6632 11.9744 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8196 12.4615 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8196 13.4355 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.9766 13.9222 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1336 13.4355 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2906 13.9222 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.7028 14.0378 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.4730 14.2975 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.2091 14.4993 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.6631 11.0002 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.9759 11.9743 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 15.9766 14.8956 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.6631 13.9226 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.8196 14.4088 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.9759 11.1189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.3189 10.7623 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.7517 10.7861 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 19.4455 15.8955 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 30.2555 12.5233 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 29.3049 12.5233 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 28.8296 13.3465 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 28.9180 14.8420 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 30.7308 11.7000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 28.6327 11.8511 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 27.8403 13.3623 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.2906 14.8977 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.0204 12.6770 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 29.3049 15.5142 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 30.2555 14.1698 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 29.3049 14.1698 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 30.7308 13.3465 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 26.8456 18.9614 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 25.9981 18.4813 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 25.1561 18.9754 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 24.3087 18.4954 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 24.3004 17.5167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 25.1424 17.0226 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 26.6777 19.9228 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 25.9925 17.5073 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 25.1619 19.9494 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 23.4666 18.9895 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 23.4528 17.0366 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 22.6120 17.5313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.7632 17.0505 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 22.6200 18.5068 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.7265 18.0011 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 19.9998 19.0143 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 20.0165 21.0113 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 22.6103 20.4971 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 20.8172 22.3433 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 22.6048 19.4938 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.7347 18.9996 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.8700 19.5087 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.8783 20.5070 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.7485 21.0012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.7567 21.9997 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.5748 17.6092 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.6448 18.1409 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.1440 20.0742 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.7824 20.2489 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.5726 21.5681 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 19.0369 19.2783 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.3243 18.5757 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.3574 18.8437 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.1069 19.8101 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.8196 20.5127 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.5690 21.4793 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2058 16.7666 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.2759 17.2984 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.7751 19.2316 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.4135 19.4063 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.2037 20.7255 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.6679 18.4358 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9554 17.7331 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9885 18.0011 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7380 18.9676 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4507 19.6702 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2001 20.6367 0.0000 C 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 2 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 43 44 1 0 0 0 0 44 45 1 0 0 0 0 45 46 1 0 0 0 0 46 47 1 0 0 0 0 6 48 1 0 0 0 0 49 50 1 0 0 0 51 50 1 0 0 0 52 51 1 0 0 0 52 53 1 0 0 0 53 54 1 1 0 0 53 58 1 0 0 0 49 58 1 0 0 0 50 55 1 6 0 0 51 56 1 1 0 0 52 57 1 1 0 0 54 59 1 0 0 0 68 69 2 0 0 0 68 70 1 0 0 0 60 68 1 1 0 0 61 60 1 0 0 0 61 62 1 0 0 0 60 75 1 0 0 0 62 63 1 0 0 0 63 64 1 0 0 0 64 65 1 0 0 0 64 75 1 0 0 0 65 66 1 0 0 0 66 67 1 0 0 0 62 71 1 6 0 0 63 72 1 1 0 0 65 73 1 1 0 0 66 74 1 6 0 0 64 76 1 1 0 0 72 77 1 0 0 0 77 78 1 0 0 0 77 79 2 0 0 0 60 56 1 6 0 0 88 89 2 0 0 0 88 90 1 0 0 0 80 88 1 1 0 0 81 80 1 0 0 0 81 82 1 0 0 0 80 94 1 0 0 0 82 83 1 0 0 0 83 84 1 0 0 0 84 85 1 0 0 0 84 94 1 0 0 0 85 86 1 0 0 0 86 87 1 0 0 0 82 91 1 6 0 0 83 92 1 1 0 0 85 93 1 1 0 0 84 95 1 1 0 0 92 96 1 0 0 0 96 97 1 0 0 0 96 98 2 0 0 0 67 99 1 0 0 0 80 74 1 6 0 0 101100 1 0 0 0 100104 1 6 0 0 101105 1 1 0 0 49106 1 1 0 0 87107 1 0 0 0 102106 1 6 0 0 86108 1 6 0 0 103109 1 0 0 0 111110 1 0 0 0 102111 1 0 0 0 111103 1 1 0 0 112100 1 0 0 0 112110 1 0 0 0 115121 1 1 0 0 116122 1 1 0 0 117123 1 6 0 0 118 57 1 1 0 0 114113 1 1 0 0 115114 1 0 0 0 116115 1 0 0 0 117116 1 0 0 0 118117 1 0 0 0 120118 1 0 0 0 114120 1 0 0 0 119113 1 0 0 0 123124 1 0 0 0 124125 2 0 0 0 124126 1 0 0 0 131137 1 0 0 0 136130 1 0 0 0 130132 1 0 0 0 132133 1 0 0 0 133134 1 0 0 0 134135 1 0 0 0 135136 1 0 0 0 136137 1 1 0 0 132122 1 1 0 0 133127 1 6 0 0 134128 1 1 0 0 135129 1 1 0 0 147141 1 0 0 0 141143 1 0 0 0 143144 1 0 0 0 144145 1 0 0 0 145146 1 0 0 0 146147 1 0 0 0 143128 1 1 0 0 144138 1 6 0 0 145139 1 1 0 0 146140 1 1 0 0 142148 1 0 0 0 147148 1 1 0 0 158152 1 0 0 0 152154 1 0 0 0 154155 1 0 0 0 155156 1 0 0 0 156157 1 0 0 0 157158 1 0 0 0 155149 1 6 0 0 156150 1 1 0 0 157151 1 1 0 0 153159 1 0 0 0 158159 1 1 0 0 154139 1 1 0 0 102101 1 0 0 0 112 48 1 1 0 0 M END > LMSP0601CL07 > > Galalpha1-3Galalpha1-3Galbeta1-3GalNAcbeta1-4(NeuAcalpha2-8NeuAcalpha2-3)Galbeta1-4Glcbeta-Cer(d18:1/24:1(15Z)) > C102H178N4O49 > 2243.16 > Sphingolipids [SP] > Acidic glycosphingolipids [SP06] > Gangliosides [SP0601] > - > > IPSQMODEBXHWCH-OSACQPNXSA-N > InChI=1S/C102H178N4O49/c1-6-8-10-12-14-16-18-20-21-22-23-24-25-26-27-29-31-33-35-37-39-41-68(122)106-56(57(118)40-38-36-34-32-30-28-19-17-15-13-11-9-7-2)52-140-94-81(132)79(130)85(66(50-113)145-94)147-98-84(135)92(155-102(100(138)139)43-59(120)70(104-54(4)116)89(154-102)77(128)65(49-112)152-101(99(136)137)42-58(119)69(103-53(3)115)88(153-101)72(123)60(121)44-107)86(67(51-114)146-98)148-93-71(105-55(5)117)87(74(125)62(46-109)141-93)149-96-82(133)91(76(127)63(47-110)143-96)151-97-83(134)90(75(126)64(48-111)144-97)150-95-80(131)78(129)73(124)61(45-108)142-95/h20-21,38,40,56-67,69-98,107-114,118-121,123-135H,6-19,22-37,39,41-52H2,1-5H3,(H,103,115)(H,104,116)(H,105,117)(H,106,122)(H,136,137)(H,138,139)/b21-20-,40-38+/t56-,57+,58-,59-,60+,61+,62+,63+,64+,65+,66+,67+,69+,70+,71+,72+,73-,74-,75-,76-,77+,78-,79+,80+,81+,82+,83+,84+,85+,86-,87+,88+,89+,90-,91-,92+,93-,94+,95-,96-,97-,98-,101+,102-/m0/s1 > [C@](CO[C@@H]1O[C@H](CO)[C@H]([C@H](O)[C@H]1O)O[C@@H]1O[C@H](CO)[C@H](O[C@@H]2O[C@@H]([C@@H]([C@@H]([C@H]2NC(C)=O)O[C@H]2[C@H](O)[C@@H](O[C@H]3[C@H](O)[C@@H](O[C@H]4[C@H](O)[C@@H](O)[C@@H](O)[C@@H](CO)O4)[C@@H](O)[C@@H](CO)O3)[C@@H](O)[C@@H](CO)O2)O)CO)[C@H](O[C@]2(O[C@@]([H])([C@H](O)[C@H](O[C@]3(O[C@@]([H])([C@H](O)[C@H](O)CO)[C@H](NC(=O)C)[C@@H](O)C3)C(O)=O)CO)[C@H](NC(=O)C)[C@@H](O)C2)C(O)=O)[C@H]1O)([H])(NC(CCCCCCCCCCCCC/C=C\CCCCCCCC)=O)[C@]([H])(O)/C=C/CCCCCCCCCCCCC > - > - > - > Hex(5)-HexNAc-NeuAc(2)-Cer 42:2;O2 > - > - > 44262458 > - > - > - > - > - > - > - $$$$