LMSP0601CT01 LIPID_MAPS_STRUCTURE_DATABASE 150156 0 0 0 999 V2000 18.9110 -6.3453 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.9673 -5.8022 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.0234 -6.3453 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.4564 -7.2892 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.3654 -7.2892 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 19.8549 -5.8006 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.3769 -7.8469 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.3769 -8.9383 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.4334 -7.3017 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.4810 -4.9123 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.4412 -4.8915 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.4827 -7.8469 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5315 -7.3017 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5802 -7.8469 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6291 -7.3017 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6780 -7.8469 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.0718 -5.8023 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1207 -6.3453 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1695 -5.8023 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2183 -6.3453 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2670 -5.8023 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3161 -6.3453 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3647 -5.8023 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4136 -6.3453 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6780 -8.9825 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4136 -7.2793 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3712 -7.8812 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3292 -7.2793 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2869 -7.8812 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2445 -7.2793 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2025 -7.8812 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6449 -9.5789 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6118 -8.9825 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5787 -9.5789 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5456 -8.9825 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5125 -9.5789 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4792 -8.9825 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4462 -9.5789 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4131 -8.9825 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.8615 -2.8900 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.0967 -2.8619 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6199 -3.6880 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6660 -3.6878 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1895 -2.8619 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6662 -2.0359 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2778 -1.3613 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0968 -4.5139 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.9913 -4.3624 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.2353 -2.8619 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.6201 -2.0359 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.6661 -0.6869 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.4829 -3.6912 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.5291 -3.6912 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.0521 -2.8654 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.1408 -1.3648 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.9598 -4.5174 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.8545 -4.3657 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.0595 -2.8495 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.5291 -0.6903 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.4829 -2.0391 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.5291 -2.0391 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.9598 -2.8654 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3813 0.4174 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1207 -0.5244 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1727 -0.7716 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9117 -1.7133 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6005 -2.4137 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5484 -2.1668 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5800 0.9803 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.8077 -1.2197 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.4854 -0.0762 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9637 -1.9601 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.3395 -3.3556 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.3922 -3.6011 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1309 -4.5444 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.7056 -2.9033 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9477 -3.6921 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9517 -1.9342 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4634 -1.0797 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9791 -0.3750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.9619 -1.9542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4539 -2.8204 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4471 -2.8117 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9533 -1.9401 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4616 -1.0740 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9676 -0.2024 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7116 -3.6481 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4571 -3.3897 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2041 -4.3339 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2601 -4.5868 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5690 -3.8958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8219 -2.9516 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1313 -2.2610 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1879 -2.5137 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4973 -1.8234 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8034 -2.8569 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6173 -2.8053 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4449 -2.2815 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0071 -5.5308 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6249 -4.1486 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3841 -1.3176 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1606 -3.3201 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7658 -2.6987 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0747 -2.0083 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4027 -4.9779 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6732 -5.1530 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0682 -5.5016 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7442 -0.9020 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9634 -3.0390 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1332 -4.0017 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0516 -4.3360 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8002 -3.7075 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6305 -2.7451 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3787 -2.1175 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2964 -2.4513 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0448 -1.8237 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6646 -2.4781 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1417 -2.3557 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0720 -1.9361 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7187 -4.0421 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.2090 -1.1555 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7121 -2.4108 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4610 -1.7835 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8678 -4.8874 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5790 -5.1252 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8747 -0.8596 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5405 -3.1813 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2214 -5.2986 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1593 -5.3516 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.5731 1.5561 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1599 0.6701 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1864 0.5849 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6260 1.3857 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0389 2.2714 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4786 3.0713 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5058 2.9864 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9453 3.7863 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0069 2.0205 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8174 1.9301 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.7537 2.6495 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6521 1.3003 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.8915 3.9566 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0125 2.3566 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4515 3.1564 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2893 0.5224 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5409 0.4767 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3592 4.6734 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0811 2.3444 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7731 -0.3010 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8535 -0.1094 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 6 40 1 0 0 0 0 41 42 1 0 0 0 43 42 1 0 0 0 44 43 1 0 0 0 44 45 1 0 0 0 45 46 1 1 0 0 45 50 1 0 0 0 41 50 1 0 0 0 42 47 1 6 0 0 43 48 1 1 0 0 44 49 1 1 0 0 46 51 1 0 0 0 53 52 1 0 0 0 54 53 1 0 0 0 52 56 1 6 0 0 53 57 1 1 0 0 41 58 1 1 0 0 54 58 1 6 0 0 55 59 1 0 0 0 61 60 1 0 0 0 54 61 1 0 0 0 61 55 1 1 0 0 62 52 1 0 0 0 62 60 1 0 0 0 65 71 1 1 0 0 66 72 1 1 0 0 67 73 1 6 0 0 68 49 1 1 0 0 64 63 1 1 0 0 65 64 1 0 0 0 66 65 1 0 0 0 67 66 1 0 0 0 68 67 1 0 0 0 70 68 1 0 0 0 64 70 1 0 0 0 69 63 1 0 0 0 73 74 1 0 0 0 74 75 2 0 0 0 74 76 1 0 0 0 80 86 1 0 0 0 85 79 1 0 0 0 79 81 1 0 0 0 81 82 1 0 0 0 82 83 1 0 0 0 83 84 1 0 0 0 84 85 1 0 0 0 85 86 1 1 0 0 81 72 1 1 0 0 82 77 1 6 0 0 84 78 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 88103 1 0 0 0 90 91 1 0 0 0 91 92 1 0 0 0 92 93 1 0 0 0 92103 1 0 0 0 93 94 1 0 0 0 94 95 1 0 0 0 90 99 1 6 0 0 91100 1 1 0 0 93101 1 1 0 0 94102 1 6 0 0 92104 1 1 0 0 100105 1 0 0 0 105106 1 0 0 0 105107 2 0 0 0 88 87 1 6 0 0 95108 1 0 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 109122 1 0 0 0 111112 1 0 0 0 112113 1 0 0 0 113114 1 0 0 0 113122 1 0 0 0 114115 1 0 0 0 115116 1 0 0 0 112120 1 1 0 0 114121 1 1 0 0 113123 1 1 0 0 120124 1 0 0 0 124125 1 0 0 0 116126 1 0 0 0 115127 1 6 0 0 124129 2 0 0 0 111128 1 6 0 0 109102 1 6 0 0 83 87 1 1 0 0 62 40 1 1 0 0 138139 2 0 0 0 138140 1 0 0 0 130138 1 1 0 0 131130 1 0 0 0 131132 1 0 0 0 130143 1 0 0 0 132133 1 0 0 0 133134 1 0 0 0 134135 1 0 0 0 134143 1 0 0 0 135136 1 0 0 0 136137 1 0 0 0 133141 1 1 0 0 135142 1 1 0 0 134144 1 1 0 0 141145 1 0 0 0 145146 1 0 0 0 137147 1 0 0 0 136148 1 6 0 0 145150 2 0 0 0 132149 1 6 0 0 130 69 1 6 0 0 M END > LMSP0601CT01 > > NeuAcalpha2-8NeuAcalpha2-3Galbeta1-3(NeuAcalpha2-6)GalNAcbeta1-4Galbeta1-4Glcbeta-Cer(d18:1/16:0) > C93H161N5O47 > 2100.04 > Sphingolipids [SP] > Acidic glycosphingolipids [SP06] > Gangliosides [SP0601] > - > > - > - > - > - > - > - > - > - > - > 44262516 > - > - > Active (generated by computational methods) > - > https://lipidmaps.org/databases/lmsd/LMSP0601CT01 $$$$