LMSP0601CK05 LIPID_MAPS_STRUCTURE_DATABASE 140145 0 0 0 999 V2000 22.3828 -5.0213 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.4554 -4.4874 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.5277 -5.0213 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.9190 -5.9489 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 21.8466 -5.9489 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 23.3108 -4.4858 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.8750 -6.4973 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.8750 -7.5700 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 19.9475 -5.9613 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.9603 -3.6130 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 20.9384 -3.5924 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.0131 -6.4973 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.0783 -5.9613 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.1433 -6.4973 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.2084 -5.9613 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2735 -6.4973 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.5923 -4.4875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.6574 -5.0213 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.7225 -4.4875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.7876 -5.0213 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.8526 -4.4875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9178 -5.0213 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9827 -4.4875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2735 -7.6134 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0478 -5.9395 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0234 -6.5309 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9992 -5.9395 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9747 -6.5309 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9502 -5.9395 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9259 -6.5309 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2581 -8.1996 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2427 -7.6134 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2272 -8.1996 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2119 -7.6134 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1964 -8.1996 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1810 -7.6134 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1655 -8.1996 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1501 -7.6134 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0478 -5.0213 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.3227 -0.8165 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 21.9962 -1.6169 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.0581 -1.6169 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.5891 -0.8047 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.6763 0.6710 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.4651 -2.4294 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 20.3948 -2.2802 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 21.0581 1.3342 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 21.9962 0.0079 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 21.0581 0.0079 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.4651 -0.8047 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0071 3.4573 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.2902 2.4818 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.6032 5.4518 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.1622 4.9448 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.3931 6.7663 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.1569 3.9549 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2983 3.4670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4453 3.9695 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4533 4.9545 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3120 5.4422 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3199 6.4272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4076 3.6188 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.1502 3.5449 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1502 2.5836 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3179 2.1033 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4855 2.5836 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4854 3.5449 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6537 4.0252 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8218 3.5449 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9902 4.0249 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3435 4.1392 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1035 4.3954 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.8565 4.5945 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3178 1.1421 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6531 2.1033 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.6537 4.9856 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3178 4.0255 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4854 4.5052 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6531 1.2590 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0047 0.9069 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4184 0.9309 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 19.6129 -0.7892 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.5651 1.8489 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3234 2.7809 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8789 1.1742 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.7869 -0.3264 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.9746 -0.7953 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.1623 -0.3261 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.1625 0.6115 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.9747 1.0805 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.9756 1.8460 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.9748 -1.7334 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.2560 -0.5690 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.3499 1.0806 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.7871 0.6116 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.6379 2.2295 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.2350 4.2935 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.5501 3.6193 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6211 3.8750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9358 3.2013 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1780 2.2662 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.1067 2.0103 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8294 5.1667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.7933 2.6895 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.4926 1.5924 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 15.3778 4.8051 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.0219 -0.5601 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1056 -1.5177 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3185 -2.0690 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4474 -1.6625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3635 -0.7052 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4933 -0.2995 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7065 -0.8500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8359 -0.4443 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6380 0.4599 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.6600 -2.2140 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.4095 0.6575 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.1509 -0.1539 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.2799 0.2516 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7336 -3.0550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1187 -3.4618 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7521 0.5146 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6604 -1.6056 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.4022 -3.0266 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.5247 -3.3155 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.8978 0.3703 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.1630 0.0488 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1337 3.5305 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1337 2.5414 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2773 2.0470 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9903 2.0471 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8218 2.5449 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1157 -8.2098 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1003 -7.6236 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0848 -8.2098 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0695 -7.6236 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0540 -8.2098 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0386 -7.6236 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0231 -8.2098 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9923 -7.6236 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 16 24 1 0 0 0 0 25 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 24 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 39 25 1 0 0 0 0 23 39 1 0 0 0 0 42 41 1 0 0 0 43 42 1 0 0 0 41 45 1 6 0 0 42 46 1 1 0 0 44 47 1 0 0 0 49 48 1 0 0 0 43 49 1 0 0 0 49 44 1 1 0 0 50 41 1 0 0 0 50 48 1 0 0 0 55 61 1 0 0 0 60 54 1 0 0 0 54 56 1 0 0 0 56 57 1 0 0 0 57 58 1 0 0 0 58 59 1 0 0 0 59 60 1 0 0 0 60 61 1 1 0 0 56 51 1 1 0 0 57 52 1 6 0 0 59 53 1 1 0 0 50 40 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 77 1 0 0 0 65 66 1 0 0 0 66 67 1 0 0 0 67 68 1 0 0 0 67 77 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 67 78 1 1 0 0 75 79 1 0 0 0 79 80 1 0 0 0 79 81 2 0 0 0 63 62 1 6 0 0 58 62 1 1 0 0 43 82 1 6 0 0 83 84 1 0 0 0 83 85 2 0 0 0 86 87 1 0 0 0 88 87 1 0 0 0 89 88 1 0 0 0 89 90 1 0 0 0 90 91 1 1 0 0 90 95 1 0 0 0 86 95 1 0 0 0 87 92 1 6 0 0 88 93 1 1 0 0 89 94 1 1 0 0 91 96 1 0 0 0 86 82 1 1 0 0 101105 1 6 0 0 102 94 1 1 0 0 98 97 1 1 0 0 99 98 1 0 0 0 100 99 1 0 0 0 101100 1 0 0 0 102101 1 0 0 0 104102 1 0 0 0 98104 1 0 0 0 103 97 1 0 0 0 105 83 1 0 0 0 99106 1 1 0 0 100 51 1 1 0 0 108107 1 0 0 0 108109 1 0 0 0 107118 1 0 0 0 109110 1 0 0 0 110111 1 0 0 0 111112 1 0 0 0 111118 1 0 0 0 112113 1 0 0 0 113114 1 0 0 0 110116 1 1 0 0 112117 1 1 0 0 111119 1 1 0 0 116120 1 0 0 0 120121 1 0 0 0 114122 1 0 0 0 113123 1 6 0 0 120125 2 0 0 0 109124 1 6 0 0 127115 1 0 0 0 127126 2 0 0 0 107127 1 1 0 0 107 93 1 6 0 0 70128 1 0 0 0 128129 1 0 0 0 129130 1 0 0 0 129131 2 0 0 0 6 40 1 0 0 0 0 69132 1 6 0 0 133134 1 0 0 0 0 134135 1 0 0 0 0 135136 1 0 0 0 0 136137 1 0 0 0 0 137138 1 0 0 0 0 138139 1 0 0 0 0 139140 1 0 0 0 0 38133 1 0 0 0 0 M END > LMSP0601CK05 > > 9-OAc-NeuAcalpha2-3Galbeta1-3GalNAcbeta1-4(NeuAcalpha2-3)Galbeta1-4Glcbeta-Cer(d18:1/24:0) > C92H162N4O40 > 1963.08 > Sphingolipids [SP] > Acidic glycosphingolipids [SP06] > Gangliosides [SP0601] > - > > - > - > - > - > - > - > - > - > - > 44262448 > - > - > Active (generated by computational methods) > - > https://lipidmaps.org/databases/lmsd/LMSP0601CK05 $$$$