LMSP0601CK06 LIPID_MAPS_STRUCTURE_DATABASE 142147 0 0 0 999 V2000 22.4578 -8.5130 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.5304 -7.9791 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.6027 -8.5130 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.9940 -9.4406 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 21.9216 -9.4406 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 23.3858 -7.9775 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.9500 -9.9890 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.9500 -11.0617 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 20.0225 -9.4530 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.0353 -7.1047 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 21.0134 -7.0841 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 19.0881 -9.9890 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.1533 -9.4530 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2183 -9.9890 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.2834 -9.4530 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.3485 -9.9890 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.6673 -7.9792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.7324 -8.5130 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.7975 -7.9792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8626 -8.5130 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.9276 -7.9792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9928 -8.5130 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0577 -7.9792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.3485 -11.1051 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1228 -9.4312 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0984 -10.0226 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0742 -9.4312 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0497 -10.0226 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0252 -9.4312 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0009 -10.0226 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3331 -11.6913 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3177 -11.1051 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3022 -11.6913 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2869 -11.1051 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2714 -11.6913 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2560 -11.1051 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2405 -11.6913 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2251 -11.1051 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1228 -8.5130 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.3977 -4.3082 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 22.0712 -5.1086 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.1331 -5.1086 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.6641 -4.2964 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.7513 -2.8207 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.5401 -5.9211 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 20.4698 -5.7719 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 21.1331 -2.1575 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 22.0712 -3.4838 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 21.1331 -3.4838 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.5401 -4.2964 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0821 -0.0344 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.3652 -1.0099 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.6782 1.9601 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.2372 1.4531 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.4681 3.2746 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.2319 0.4632 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3733 -0.0247 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5203 0.4778 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5283 1.4628 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3870 1.9505 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3949 2.9355 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4826 0.1271 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.2252 0.0532 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2252 -0.9081 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3929 -1.3884 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5605 -0.9081 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5604 0.0532 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7287 0.5335 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8968 0.0532 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0652 0.5332 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4185 0.6475 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1785 0.9037 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9315 1.1028 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3928 -2.3496 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7281 -1.3884 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.7287 1.4939 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3928 0.5338 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5604 1.0135 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7281 -2.2327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0797 -2.5848 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4934 -2.5608 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 19.6879 -4.2809 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.6401 -1.6428 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3984 -0.7108 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9539 -2.3175 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.8619 -3.8181 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.0496 -4.2870 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2373 -3.8178 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2375 -2.8802 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.0497 -2.4112 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.0506 -1.6457 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.0498 -5.2251 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.3310 -4.0607 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.4249 -2.4111 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.8621 -2.8801 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.7129 -1.2622 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.3100 0.8018 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.6251 0.1276 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.6961 0.3833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0108 -0.2904 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2530 -1.2255 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.1817 -1.4814 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.9044 1.6750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.8683 -0.8022 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.5676 -1.8993 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 15.4528 1.3134 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.0969 -4.0518 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1806 -5.0094 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3935 -5.5607 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5224 -5.1542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4385 -4.1969 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5683 -3.7912 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7815 -4.3417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9109 -3.9360 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7130 -3.0318 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.7350 -5.7057 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.4845 -2.8342 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.2259 -3.6456 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.3549 -3.2401 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8086 -6.5467 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1937 -6.9535 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8271 -2.9771 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.7354 -5.0973 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.4772 -6.5183 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.5997 -6.8072 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.9728 -3.1214 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.2380 -3.4429 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2087 0.0388 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2087 -0.9503 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3523 -1.4447 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0653 -1.4446 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8968 -0.9468 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1630 -11.6875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1476 -11.1013 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1321 -11.6875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1168 -11.1013 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1013 -11.6875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0859 -11.1013 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0704 -11.6875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9450 -11.1013 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9362 -11.7375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9516 -11.1513 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 141142 1 0 0 0 0 140141 1 0 0 0 0 M END > LMSP0601CK06 > > 9-OAc-NeuAcalpha2-3Galbeta1-3GalNAcbeta1-4(NeuAcalpha2-3)Galbeta1-4Glcbeta-Cer(d18:1/26:0) > C94H166N4O40 > 1991.11 > Sphingolipids [SP] > Acidic glycosphingolipids [SP06] > Gangliosides [SP0601] > - > > - > - > - > - > - > - > - > - > - > 44262449 > - > - > Active (generated by computational methods) > - > https://lipidmaps.org/databases/lmsd/LMSP0601CK06 $$$$