LMSP0601BH07 LIPID_MAPS_STRUCTURE_DATABASE 148154 0 0 0 999 V2000 29.6110 9.6082 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 28.6777 10.1452 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 27.7442 9.6082 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 30.1505 8.6748 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 29.0713 8.6748 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 30.5445 10.1468 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 28.0938 8.1231 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 28.0938 7.0437 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 27.1605 8.6623 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 29.1857 11.0254 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 28.1575 11.0459 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 26.2204 8.1231 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 25.2797 8.6623 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 24.3390 8.1231 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.3983 8.6623 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.4576 8.1231 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 26.8031 10.1451 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 25.8624 9.6082 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 24.9218 10.1451 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.9810 9.6082 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.0402 10.1451 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.0997 9.6082 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.1589 10.1451 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.2183 9.6082 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.4576 7.0001 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.2183 8.6843 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.1875 8.0893 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.1568 8.6843 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.1260 8.0893 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.0952 8.6843 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0646 8.0893 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.4360 6.4102 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.4143 7.0001 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.3925 6.4102 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.3708 7.0001 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.3492 6.4102 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.3274 7.0001 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.3057 6.4102 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2839 6.4102 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2622 7.0001 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2406 6.4102 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2188 7.0001 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1971 6.4102 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1753 7.0001 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1537 6.4102 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1319 7.0001 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1102 6.4102 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 30.5510 13.0255 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 25.9733 13.8903 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 25.0550 13.6443 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 24.3829 14.3165 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 24.6288 15.2347 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 25.5470 15.4808 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 25.7489 16.2297 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 24.8088 12.7261 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 23.4321 14.3166 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 23.9567 15.9069 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 26.2193 14.8085 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 26.4977 16.4313 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 22.4815 14.3165 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.4815 13.3425 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.6379 12.8554 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.7944 13.3425 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.7944 14.3165 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.9514 14.8032 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.1084 14.3165 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.2656 14.8031 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.6776 14.9188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.4477 15.1784 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 22.1838 15.3803 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 21.6378 11.8813 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 19.9507 12.8554 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 19.9514 15.7765 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.3274 13.2753 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 21.6378 14.8035 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 20.7944 15.2898 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.9507 11.9998 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.2936 11.6432 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.7264 11.6671 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.3266 13.2939 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.3267 12.3198 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.4832 11.8327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6395 12.3198 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6395 13.2938 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7965 13.7805 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9535 13.2938 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1105 13.7805 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.5228 13.8961 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.2930 14.1558 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.0291 14.3576 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.4830 10.8585 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.7959 11.8326 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.7965 14.7539 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.4830 13.7809 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.6395 14.2671 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.7959 10.9772 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1389 10.6206 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5717 10.6444 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.2655 15.7538 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 29.0755 12.3816 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 28.1249 12.3816 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 27.6495 13.2048 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 27.7379 14.7003 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 29.5509 11.5583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 27.4526 11.7094 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 26.6603 13.2206 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.1105 14.7560 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.8404 12.5353 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 28.1249 15.3725 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 29.0755 14.0281 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 28.1249 14.0281 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 29.5509 13.2048 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 25.6656 18.8197 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 24.8180 18.3396 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.9761 18.8337 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.1287 18.3537 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.1204 17.3750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.9624 16.8809 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 25.4977 19.7811 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 24.8124 17.3656 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 23.9819 19.8077 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 22.2865 18.8478 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 22.2728 16.8949 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 21.4320 17.3896 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.5832 16.9088 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 21.4400 18.3651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.5465 17.8594 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.8197 18.8726 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.8364 20.8696 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 21.4303 20.3554 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 19.6371 22.2016 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 21.4248 19.3521 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.5547 18.8579 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.6900 19.3670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.6983 20.3653 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.5684 20.8595 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.5767 21.8580 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.8056 16.8714 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.0649 15.8827 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.3438 16.8956 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.0860 18.8848 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.5906 18.2550 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.9521 18.3784 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.9452 17.3777 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.0720 16.8835 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.2114 17.3898 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.2186 18.3905 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.3580 18.8968 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 102101 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 142148 1 0 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 147148 1 1 0 0 143128 1 1 0 0 144138 1 6 0 0 145139 1 1 0 0 146140 1 1 0 0 112 48 1 1 0 0 M END > LMSP0601BH07 > Gal-GD1b(d18:1/24:1(15Z)) > Galalpha1-3Galbeta1-3GalNAcbeta1-4(NeuAcalpha2-8NeuAcalpha2-3)Galbeta1-4Glcbeta-Cer(d18:1/24:1(15Z)) > C96H168N4O44 > 2081.10 > Sphingolipids [SP] > Acidic glycosphingolipids [SP06] > Gangliosides [SP0601] > - > > HFFJKJMVDHSBCR-BSNGVNNXSA-N > InChI=1S/C96H168N4O44/c1-6-8-10-12-14-16-18-20-21-22-23-24-25-26-27-29-31-33-35-37-39-41-66(115)100-55(56(111)40-38-36-34-32-30-28-19-17-15-13-11-9-7-2)51-131-89-78(124)76(122)81(64(49-106)135-89)137-92-80(126)87(144-96(94(129)130)43-58(113)68(98-53(4)109)85(143-96)74(120)63(48-105)141-95(93(127)128)42-57(112)67(97-52(3)108)84(142-95)70(116)59(114)44-101)82(65(50-107)136-92)138-88-69(99-54(5)110)83(72(118)61(46-103)132-88)139-91-79(125)86(73(119)62(47-104)134-91)140-90-77(123)75(121)71(117)60(45-102)133-90/h20-21,38,40,55-65,67-92,101-107,111-114,116-126H,6-19,22-37,39,41-51H2,1-5H3,(H,97,108)(H,98,109)(H,99,110)(H,100,115)(H,127,128)(H,129,130)/b21-20-,40-38+/t55-,56+,57-,58-,59+,60+,61+,62+,63+,64+,65+,67+,68+,69+,70+,71-,72-,73-,74+,75-,76+,77+,78+,79+,80+,81+,82-,83+,84+,85+,86-,87+,88-,89+,90-,91-,92-,95+,96-/m0/s1 > [C@](CO[C@@H]1O[C@H](CO)[C@@H](O[C@@H]2O[C@H](CO)[C@H](O[C@@H]3O[C@@H]([C@@H]([C@@H]([C@H]3NC(C)=O)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)O)CO)[C@H](O[C@]3(O[C@@]([H])([C@H](O)[C@H](O[C@]4(O[C@@]([H])([C@H](O)[C@H](O)CO)[C@H](NC(=O)C)[C@@H](O)C4)C(O)=O)CO)[C@H](NC(=O)C)[C@@H](O)C3)C(O)=O)[C@H]2O)[C@H](O)[C@H]1O)([H])(NC(CCCCCCCCCCCCC/C=C\CCCCCCCC)=O)[C@]([H])(O)/C=C/CCCCCCCCCCCCC > - > - > - > Hex(4)-HexNAc-NeuAc(2)-Cer 42:2;O2 > - > - > 178333131 > - > - > - > - > - > - > - $$$$