Accord 08271317182D 140147 0 0 0 0 0 0 0 0999 V2000 24.3404 7.0147 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 23.6858 7.3917 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 23.0309 7.0147 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 24.7189 6.3601 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 23.9620 6.3601 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 24.9954 7.3928 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.2762 5.9731 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.2762 5.2159 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 22.6215 6.3514 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 24.0422 8.0090 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 23.3209 8.0235 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 21.9620 5.9731 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.3020 6.3514 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.6422 5.9731 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.9823 6.3514 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.3223 5.9731 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.6624 6.3514 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.0026 5.9731 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.3426 6.3514 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.6827 5.9731 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.0228 6.3514 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.3629 5.9731 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7030 6.3514 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0431 5.9731 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3832 6.3514 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7233 5.9731 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0634 6.3514 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4035 5.9731 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7436 6.3514 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.3707 7.3916 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.7109 7.0147 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.0509 7.3916 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.3910 7.0147 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.7311 7.3916 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.0712 7.0147 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.4113 7.3916 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.7514 7.0147 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.0915 7.3916 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.4316 7.0147 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.7717 7.3916 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1118 7.0147 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4519 7.3916 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7920 7.0147 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 25.0000 9.4126 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 24.4011 9.1822 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 23.5593 9.4229 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 22.7125 9.2010 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 22.2747 9.9592 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 23.1164 9.7187 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 22.7250 9.9447 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.6625 9.0433 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 22.0747 9.3719 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 21.8041 9.6875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 23.9634 9.9405 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 23.1816 10.2513 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 21.2052 9.4572 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 20.3635 9.6978 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 19.5166 9.4760 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 19.0788 10.2341 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 19.9205 9.9936 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 19.5291 10.2197 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.4667 9.3182 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.8788 9.6469 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 19.0689 10.7273 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 20.7675 10.2154 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 19.9857 10.5262 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.0035 8.8637 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 17.1618 9.1044 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 16.3149 8.8825 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 15.8771 9.6406 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 16.7188 9.4001 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 16.3274 9.6262 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2650 8.7247 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 15.6771 9.0534 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.4065 9.3690 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.5658 9.6219 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.7840 9.9327 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.1465 8.5400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.4389 8.3304 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.7652 8.5400 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.8018 8.2702 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 13.9601 8.5109 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 13.1132 8.2890 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 12.6754 9.0471 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 13.5171 8.8066 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 13.1257 9.0327 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0633 8.1312 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.4755 8.4599 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.6655 9.5403 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.3641 9.0284 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.5823 9.3392 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6001 7.6767 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 10.7584 7.9174 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 9.9115 7.6955 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.4737 8.4536 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 10.3154 8.2131 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 9.9240 8.4392 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8616 7.5377 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.2738 7.8664 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0031 8.1820 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.1624 8.4349 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.3806 8.7457 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.7431 7.3530 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0355 7.1435 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3618 7.3530 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3984 7.0832 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.5567 7.3239 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.7098 7.1020 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.2720 7.8601 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.1137 7.6196 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.7223 7.8457 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6599 6.9442 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0721 7.2729 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2622 8.3533 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.9607 7.8414 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1789 8.1522 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1992 6.9442 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.8190 6.2859 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.0836 6.4785 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.1684 6.2696 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.7327 6.9280 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.2442 6.7971 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3728 6.4343 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6990 6.0939 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1684 5.7673 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4682 6.7354 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.9833 9.8921 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 12.3814 10.5277 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 11.5395 10.7678 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 11.5486 11.6433 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 12.1506 11.0077 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 11.9288 11.4016 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2770 10.1484 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.0775 11.2396 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.0052 11.6490 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.9926 10.7675 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.4778 11.4330 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.0809 10.0497 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2259 9.7205 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7527 10.2438 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 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 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 3 30 2 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 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 6 44 1 0 0 0 0 45 46 1 1 0 0 0 47 46 1 1 0 0 0 48 47 1 1 0 0 0 48 49 1 0 0 0 0 49 50 1 0 0 0 0 49 54 1 0 0 0 0 45 54 1 0 0 0 0 46 51 1 0 0 0 0 47 52 1 0 0 0 0 48 53 1 0 0 0 0 50 55 1 0 0 0 0 44 45 1 0 0 0 0 56 57 1 1 0 0 0 58 57 1 1 0 0 0 59 58 1 1 0 0 0 59 60 1 0 0 0 0 60 61 1 0 0 0 0 60 65 1 0 0 0 0 56 65 1 0 0 0 0 57 62 1 0 0 0 0 58 63 1 0 0 0 0 59 64 1 0 0 0 0 61 66 1 0 0 0 0 53 56 1 0 0 0 0 67 68 1 1 0 0 0 69 68 1 1 0 0 0 70 69 1 1 0 0 0 70 71 1 0 0 0 0 71 72 1 0 0 0 0 71 76 1 0 0 0 0 67 76 1 0 0 0 0 68 73 1 0 0 0 0 69 74 1 0 0 0 0 70 75 1 0 0 0 0 72 77 1 0 0 0 0 73 78 1 0 0 0 0 78 79 1 0 0 0 0 78 80 2 0 0 0 0 63 67 1 0 0 0 0 81 82 1 1 0 0 0 83 82 1 1 0 0 0 84 83 1 1 0 0 0 84 85 1 0 0 0 0 85 86 1 0 0 0 0 85 90 1 0 0 0 0 81 90 1 0 0 0 0 82 87 1 0 0 0 0 83 88 1 0 0 0 0 84 89 1 0 0 0 0 86 91 1 0 0 0 0 74 81 1 0 0 0 0 92 93 1 1 0 0 0 94 93 1 1 0 0 0 95 94 1 1 0 0 0 95 96 1 0 0 0 0 96 97 1 0 0 0 0 96101 1 0 0 0 0 92101 1 0 0 0 0 93 98 1 0 0 0 0 94 99 1 0 0 0 0 95100 1 0 0 0 0 97102 1 0 0 0 0 98103 1 0 0 0 0 103104 1 0 0 0 0 103105 2 0 0 0 0 88 92 1 0 0 0 0 106107 1 1 0 0 0 108107 1 1 0 0 0 109108 1 1 0 0 0 109110 1 0 0 0 0 110111 1 0 0 0 0 110115 1 0 0 0 0 106115 1 0 0 0 0 107112 1 0 0 0 0 108113 1 0 0 0 0 109114 1 0 0 0 0 111116 1 0 0 0 0 99106 1 0 0 0 0 117118 1 1 0 0 0 118119 1 1 0 0 0 120119 1 1 0 0 0 120121 1 0 0 0 0 121122 1 0 0 0 0 121126 1 0 0 0 0 118123 1 0 0 0 0 119124 1 0 0 0 0 120125 1 0 0 0 0 117126 1 0 0 0 0 112117 1 0 0 0 0 127128 1 1 0 0 0 129128 1 1 0 0 0 130129 1 1 0 0 0 130131 1 0 0 0 0 131132 1 0 0 0 0 131136 1 0 0 0 0 127136 1 0 0 0 0 128133 1 0 0 0 0 129134 1 0 0 0 0 130135 1 0 0 0 0 132137 1 0 0 0 0 133138 1 0 0 0 0 138139 1 0 0 0 0 138140 2 0 0 0 0 91127 1 0 0 0 0 M END > LMISSP0504AX03 > > Fucalpha1-2Galbeta1-3GlcNAcbeta1-3(GlcNAcbeta1-6)Galbeta1-3GlcNAcbeta1-3Galbeta1-4Glcbeta-Cer(d18:1/20:0) > C92H164N4O42 > 1997.08 > Sphingolipids [SP] > Neutral glycosphingolipids [SP05] > Galbeta1-3GlcNAcbeta1-3Galbeta1-4Glc- (Lacto series) [SP0504] > - > > - > - > - > - > - > - > - > - > - > 44260798 > - > - > Active (generated by computational methods) > - $$$$