LMSP0601AK05 LIPID_MAPS_STRUCTURE_DATABASE 112115 0 0 0 999 V2000 21.1430 -5.8350 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.2728 -5.3339 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.4023 -5.8350 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.6461 -6.7053 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.6400 -6.7053 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 22.0137 -5.3324 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.7283 -7.2196 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.7283 -8.2261 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 20.7466 -4.5133 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 19.7878 -4.4941 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.0082 -6.7053 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.2882 -7.2196 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.5682 -6.7053 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8482 -7.2196 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.1282 -6.7053 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.4082 -7.2196 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6882 -6.7053 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9682 -7.2196 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2482 -6.7053 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5282 -7.2196 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8082 -6.7053 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0882 -7.2196 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3682 -6.7053 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6482 -7.2196 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 -6.7053 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.6822 -5.3339 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.9622 -5.8350 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2422 -5.3339 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.5222 -5.8350 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.8022 -5.3339 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0822 -5.8350 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3622 -5.3339 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6422 -5.8350 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9222 -5.3339 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2022 -5.8350 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4822 -5.3339 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7622 -5.8350 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0422 -5.3339 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3222 -5.8350 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.0137 -0.3291 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 21.0137 -0.3291 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.5136 -1.1951 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.5137 -1.1951 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.0137 -0.3291 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.5137 0.5369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.1066 1.2440 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.0136 -2.0611 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.8065 -1.9022 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.0137 -0.3291 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 20.5137 0.5369 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 19.5137 1.9511 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.0478 -0.0703 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.3406 -0.7773 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.3748 -0.5185 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1160 0.4474 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.8231 1.1544 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6128 1.9428 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.5994 -1.7432 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.5087 -1.0185 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.1500 0.7062 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.7890 0.8956 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.1891 2.5205 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.5427 -0.7597 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2776 -1.7494 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2878 -2.0146 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5633 -1.2901 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8285 -0.3004 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1045 0.4236 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1154 0.1586 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3914 0.8826 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9059 -0.2011 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7592 -0.1470 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.5299 0.4022 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.0226 -3.0044 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.5735 -1.5553 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.3695 1.4126 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0385 -0.6868 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.8182 -0.0352 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.0935 0.6885 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3406 -2.4247 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5760 -2.6080 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0382 -2.9739 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0266 -0.3954 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7614 -1.3851 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7716 -1.6503 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0472 -0.9257 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3124 0.0640 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5884 0.7879 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5993 0.5230 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8753 1.2469 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3898 0.1632 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2431 0.2174 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0138 0.7665 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5064 -2.6401 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0574 -1.1910 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.8534 1.7769 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3343 -0.4660 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8863 0.9820 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3020 0.3291 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5774 1.0529 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8245 -2.0603 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0599 -2.2437 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5221 -2.6096 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.6503 1.8485 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.2500 -7.2099 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5300 -6.6956 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8100 -7.2099 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0900 -6.6956 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3700 -7.2099 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6500 -6.6956 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9500 -7.2072 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2300 -6.6928 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 5 1 0 0 0 0 2 9 1 1 0 0 0 2 10 1 6 0 0 0 7 11 1 0 0 0 0 11 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 16 17 1 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 24 25 1 0 0 0 0 3 26 2 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 31 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 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 6 0 0 46 51 1 0 0 0 41 40 1 1 0 0 52 53 1 0 0 0 54 53 1 0 0 0 55 54 1 0 0 0 55 56 1 0 0 0 56 57 1 1 0 0 56 61 1 0 0 0 52 61 1 0 0 0 53 58 1 6 0 0 54 59 1 1 0 0 55 60 1 1 0 0 57 62 1 0 0 0 52 49 1 1 0 0 71 72 2 0 0 0 71 73 1 0 0 0 63 71 1 1 0 0 64 63 1 0 0 0 64 65 1 0 0 0 63 78 1 0 0 0 65 66 1 0 0 0 66 67 1 0 0 0 67 68 1 0 0 0 67 78 1 0 0 0 68 69 1 0 0 0 69 70 1 0 0 0 65 74 1 6 0 0 66 75 1 1 0 0 68 76 1 1 0 0 69 77 1 6 0 0 67 79 1 1 0 0 75 80 1 0 0 0 80 81 1 0 0 0 80 82 2 0 0 0 63 59 1 6 0 0 91 92 2 0 0 0 91 93 1 0 0 0 83 91 1 1 0 0 84 83 1 0 0 0 84 85 1 0 0 0 83 99 1 0 0 0 85 86 1 0 0 0 86 87 1 0 0 0 87 88 1 0 0 0 87 99 1 0 0 0 88 89 1 0 0 0 89 90 1 0 0 0 85 94 1 6 0 0 86 95 1 1 0 0 88 96 1 1 0 0 89 97 1 6 0 0 90 98 1 0 0 0 87100 1 1 0 0 95101 1 0 0 0 101102 1 0 0 0 101103 2 0 0 0 70104 1 0 0 0 83 77 1 6 0 0 105106 1 0 0 0 0 106107 1 0 0 0 0 107108 1 0 0 0 0 108109 1 0 0 0 0 109110 1 0 0 0 0 25105 1 0 0 0 0 111112 1 0 0 0 0 110111 1 0 0 0 0 M END > LMSP0601AK05 > GD3(d18:1/24:0) > NeuAcalpha2-8NeuAcalpha2-3Galbeta1-4Glcbeta-Cer(d18:1/24:0) > C76H137N3O29 > 1555.93 > Sphingolipids [SP] > Acidic glycosphingolipids [SP06] > Gangliosides [SP0601] > - > > - > - > - > - > - > - > SLM:000487082 > - > - > 44262048 > - > - > Active (generated by computational methods) > - > https://lipidmaps.org/databases/lmsd/LMSP0601AK05 $$$$