Mrv0541 02241202442D 167174 0 0 1 0 999 V2000 6.2782 -17.1186 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5637 -16.7061 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8493 -17.1186 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5637 -15.8811 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.2782 -15.4686 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.9927 -15.8811 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.7071 -15.4686 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7071 -14.6436 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.9927 -14.2311 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2782 -14.6436 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5637 -14.2311 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.5637 -13.4061 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.8251 -12.9796 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0864 -13.4061 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3621 -12.7610 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8493 -14.6436 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.9059 -13.9180 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6265 -13.5614 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2052 -13.3701 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5570 -14.4162 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9927 -16.7061 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.1582 -12.3760 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1563 -13.2009 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8699 -13.6151 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.4409 -13.6118 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.7274 -13.1977 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 10.7293 -12.3727 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 10.0158 -11.9586 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3004 -12.3694 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 9.2985 -13.1944 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.0120 -13.6085 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0101 -14.4335 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 9.2947 -14.8444 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 9.2927 -15.6973 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0304 -16.1254 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.7236 -14.8476 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.6112 -12.0914 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0645 -12.5567 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4091 -11.1591 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.3998 -11.4232 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.4447 -11.9618 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.9473 -8.5438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2458 -9.3129 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.7289 -9.9560 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 10.0275 -10.7250 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 10.8428 -10.8511 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 11.3596 -10.2080 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 11.0611 -9.4390 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.1749 -10.3341 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.1413 -11.6202 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.8675 -9.8038 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.5036 -7.9208 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.2253 -9.0615 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5137 -9.8345 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 12.9886 -10.4707 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 13.2770 -11.2437 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 14.0906 -11.3804 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 14.6158 -10.7441 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 14.3274 -9.9712 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.4294 -10.8809 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.3790 -12.1533 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.7518 -11.8800 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.4118 -8.9249 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3024 -11.8973 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3053 -11.0723 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5922 -10.6573 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0212 -10.6623 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7342 -11.0773 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.7313 -11.9024 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.4443 -12.3173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1602 -11.9074 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.1631 -11.0823 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4501 -10.6673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4530 -9.8423 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.1689 -9.4323 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.1719 -8.5794 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4348 -8.1503 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7470 -9.7719 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7400 -9.4273 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0428 -11.7684 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3284 -11.2555 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4734 -12.3179 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1359 -12.4058 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.3564 -6.9880 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8278 -7.6213 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.0149 -7.4802 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.4863 -8.1136 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.7705 -8.8881 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.5833 -9.0292 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 9.1119 -8.3959 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2418 -9.5214 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6735 -7.9724 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7307 -6.7057 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0722 -6.2135 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5259 -10.2959 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1861 -10.7107 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3388 -10.4371 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2347 -5.1702 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6898 -5.7897 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.8809 -5.6278 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.3362 -6.2473 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.6003 -7.0288 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.4093 -7.1909 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.9540 -6.5713 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0555 -7.6484 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5272 -6.0854 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6168 -4.8462 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9705 -4.3886 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9012 -5.4407 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0456 -4.6284 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4144 -4.0973 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8213 -4.3474 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4525 -4.8786 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 2.3081 -5.6908 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 2.9393 -6.2220 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7150 -5.9409 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.8594 -5.1287 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2281 -4.5975 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3725 -3.7852 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.1482 -3.5042 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.2975 -2.6644 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6449 -2.1152 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8008 -4.0533 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7413 -3.2540 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9961 -6.7166 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8083 -6.8610 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4649 -7.3478 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5325 -5.9719 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.1490 -11.2845 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8583 -10.8632 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 17.5778 -11.2668 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 18.2872 -10.8456 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.0068 -11.2491 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.7160 -10.8278 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.4356 -11.2315 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.1450 -10.8101 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.8645 -11.2137 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.5738 -10.7924 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.2934 -11.1961 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 24.0027 -10.7748 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 24.7222 -11.1783 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 25.4315 -10.7571 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 26.1511 -11.1607 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 26.8604 -10.7394 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 27.5800 -11.1431 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.5880 -12.0919 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.8481 -10.0382 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 28.2894 -10.7218 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 29.7081 -9.6103 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 28.9942 -10.0238 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 28.2792 -9.6121 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 27.5653 -10.0255 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 26.8503 -9.6138 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 26.1363 -10.0271 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 25.4213 -9.6155 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 24.7068 -9.6164 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.9929 -10.0297 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.2779 -9.6181 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 22.5639 -10.0315 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.8490 -9.6198 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.1349 -10.0331 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.4199 -9.6215 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.7060 -10.0349 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.9910 -9.6232 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.2770 -10.0366 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.5621 -9.6249 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.5611 -8.7999 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 5 4 1 1 0 0 0 5 6 1 0 0 0 0 5 10 1 0 0 0 0 6 7 1 0 0 0 0 6 21 1 6 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 17 1 1 0 0 0 8 20 1 6 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 16 1 6 0 0 0 12 13 1 0 0 0 0 12 15 1 1 0 0 0 13 14 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 22 23 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 26 25 1 1 0 0 0 26 27 1 0 0 0 0 26 31 1 0 0 0 0 27 28 1 0 0 0 0 27 41 1 6 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 29 37 1 1 0 0 0 29 40 1 6 0 0 0 30 31 1 0 0 0 0 31 32 1 0 0 0 0 32 33 1 0 0 0 0 32 36 1 6 0 0 0 33 34 1 0 0 0 0 33 20 1 1 0 0 0 34 35 1 0 0 0 0 37 38 2 0 0 0 0 37 39 1 0 0 0 0 43 42 1 1 0 0 0 42 52 1 0 0 0 0 43 44 1 0 0 0 0 43 48 1 0 0 0 0 44 45 1 0 0 0 0 44 51 1 1 0 0 0 45 46 1 0 0 0 0 45 40 1 1 0 0 0 46 47 1 0 0 0 0 46 50 1 6 0 0 0 47 48 1 0 0 0 0 47 49 1 1 0 0 0 54 53 1 1 0 0 0 53 63 1 0 0 0 0 54 55 1 0 0 0 0 54 59 1 0 0 0 0 55 56 1 0 0 0 0 55 49 1 6 0 0 0 56 57 1 0 0 0 0 56 62 1 1 0 0 0 57 58 1 0 0 0 0 57 61 1 6 0 0 0 58 59 1 0 0 0 0 58 60 1 1 0 0 0 64 65 1 0 0 0 0 65 66 2 0 0 0 0 65 67 1 0 0 0 0 68 67 1 1 0 0 0 68 69 1 0 0 0 0 68 73 1 0 0 0 0 69 70 1 0 0 0 0 69 83 1 6 0 0 0 70 71 1 0 0 0 0 71 72 1 0 0 0 0 71 80 1 1 0 0 0 71 15 1 6 0 0 0 72 73 1 0 0 0 0 73 74 1 0 0 0 0 74 75 1 0 0 0 0 74 79 1 6 0 0 0 75 76 1 0 0 0 0 75 78 1 1 0 0 0 76 77 1 0 0 0 0 80 81 2 0 0 0 0 80 82 1 0 0 0 0 85 84 1 1 0 0 0 84 94 1 0 0 0 0 85 86 1 0 0 0 0 85 90 1 0 0 0 0 86 87 1 0 0 0 0 86 93 1 1 0 0 0 87 88 1 0 0 0 0 87 92 1 1 0 0 0 88 89 1 0 0 0 0 88 91 1 6 0 0 0 89 90 1 0 0 0 0 89 51 1 1 0 0 0 95 91 1 0 0 0 0 96 95 1 0 0 0 0 97 95 2 0 0 0 0 99 98 1 1 0 0 0 98108 1 0 0 0 0 99100 1 0 0 0 0 99104 1 0 0 0 0 100101 1 0 0 0 0 100107 1 1 0 0 0 101102 1 0 0 0 0 101106 1 1 0 0 0 102103 1 0 0 0 0 102105 1 6 0 0 0 103104 1 0 0 0 0 103 92 1 1 0 0 0 109110 1 0 0 0 0 110111 2 0 0 0 0 110112 1 0 0 0 0 113112 1 1 0 0 0 113114 1 0 0 0 0 113118 1 0 0 0 0 114115 1 0 0 0 0 114128 1 6 0 0 0 115116 1 0 0 0 0 116117 1 0 0 0 0 116125 1 1 0 0 0 116106 1 6 0 0 0 117118 1 0 0 0 0 118119 1 0 0 0 0 119120 1 0 0 0 0 119124 1 6 0 0 0 120121 1 0 0 0 0 120123 1 1 0 0 0 121122 1 0 0 0 0 125126 2 0 0 0 0 125127 1 0 0 0 0 129 60 1 0 0 0 0 130129 1 0 0 0 0 131130 1 0 0 0 0 132131 1 0 0 0 0 133132 2 0 0 0 0 134133 1 0 0 0 0 135134 1 0 0 0 0 136135 1 0 0 0 0 137136 1 0 0 0 0 138137 1 0 0 0 0 139138 1 0 0 0 0 140139 1 0 0 0 0 141140 1 0 0 0 0 142141 1 0 0 0 0 143142 1 0 0 0 0 144143 1 0 0 0 0 145144 1 0 0 0 0 131146 1 1 0 0 0 130147 1 6 0 0 0 148145 1 0 0 0 0 150149 1 0 0 0 0 151150 1 0 0 0 0 152151 1 0 0 0 0 153152 1 0 0 0 0 154153 1 0 0 0 0 155154 1 0 0 0 0 156155 2 0 0 0 0 157156 1 0 0 0 0 158157 1 0 0 0 0 159158 1 0 0 0 0 160159 1 0 0 0 0 161160 1 0 0 0 0 162161 1 0 0 0 0 163162 1 0 0 0 0 164163 1 0 0 0 0 165164 1 0 0 0 0 166165 1 0 0 0 0 167166 2 0 0 0 0 147166 1 0 0 0 0 M END > BMDB0011951 > bmdb > CCCCCCCCCCCCC\C=C\[C@@H](O)[C@H](CO[C@@H]1O[C@H](CO)[C@@H](O[C@@H]2O[C@H](CO)[C@H](O[C@@H]3O[C@H](CO)[C@H](O)[C@H](O[C@@H]4O[C@H](CO)[C@H](O)[C@H](O[C@@]5(C[C@H](O)[C@@H](NC(C)=O)C(O5)[C@H](O)[C@H](O)CO)C(O)=O)[C@H]4O)[C@H]3CC(C)=O)[C@H](O[C@@]3(C[C@H](O)[C@@H](NC(C)=O)C(O3)[C@H](O)[C@@H](CO)O[C@@]3(C[C@H](O)[C@@H](NC(C)=O)C(O3)[C@H](O)[C@@H](CO)O[C@@]3(C[C@H](O)[C@@H](NC(C)=O)C(O3)[C@H](O)[C@H](O)CO)C(O)=O)C(O)=O)C(O)=O)[C@H]2O)[C@H](O)[C@H]1O)NC(=O)CCCCCCCCC\C=C/CCCCCC > InChI=1S/C107H181N5O55/c1-8-10-12-14-16-18-20-22-23-25-27-29-31-33-35-37-72(133)112-58(59(126)36-34-32-30-28-26-24-21-19-17-15-13-11-9-2)51-152-97-84(141)83(140)88(70(49-119)155-97)158-99-86(143)95(89(71(50-120)156-99)159-96-57(38-52(3)121)87(79(136)66(45-115)153-96)157-98-85(142)94(80(137)67(46-116)154-98)166-106(102(148)149)41-62(129)74(109-54(5)123)91(163-106)78(135)65(132)44-114)167-107(103(150)151)42-63(130)76(111-56(7)125)93(165-107)82(139)69(48-118)161-105(101(146)147)40-61(128)75(110-55(6)124)92(164-105)81(138)68(47-117)160-104(100(144)145)39-60(127)73(108-53(4)122)90(162-104)77(134)64(131)43-113/h18,20,34,36,57-71,73-99,113-120,126-132,134-143H,8-17,19,21-33,35,37-51H2,1-7H3,(H,108,122)(H,109,123)(H,110,124)(H,111,125)(H,112,133)(H,144,145)(H,146,147)(H,148,149)(H,150,151)/b20-18-,36-34+/t57-,58+,59-,60+,61+,62+,63+,64-,65-,66-,67-,68-,69-,70-,71-,73-,74-,75-,76-,77-,78-,79+,80+,81-,82-,83-,84-,85-,86-,87-,88-,89+,90?,91?,92?,93?,94+,95-,96+,97-,98+,99+,104-,105-,106+,107+/m1/s1 > OIQDHZKSBJYFLC-ULIFKOQUSA-N > C107H181N5O55 > 2417.5825 > 2416.152005027 > 55 > 253.3208889573193 > 0 > 34 > 0 > 0 > (2S,4S,5R)-2-{[(2R,3R,4S,5S,6R)-2-{[(2S,3R,4R,5R,6R)-2-{[(2R,3S,4R,5R,6S)-4-{[(2S,4S,5R)-2-carboxy-6-[(1S,2R)-2-{[(2S,4S,5R)-2-carboxy-6-[(1S,2R)-2-{[(2S,4S,5R)-2-carboxy-5-acetamido-4-hydroxy-6-[(1R,2R)-1,2,3-trihydroxypropyl]oxan-2-yl]oxy}-1,3-dihydroxypropyl]-5-acetamido-4-hydroxyoxan-2-yl]oxy}-1,3-dihydroxypropyl]-5-acetamido-4-hydroxyoxan-2-yl]oxy}-6-{[(2R,3S,4R,5R,6R)-4,5-dihydroxy-6-{[(2S,3R,4E)-3-hydroxy-2-[(11Z)-octadec-11-enamido]octadec-4-en-1-yl]oxy}-2-(hydroxymethyl)oxan-3-yl]oxy}-5-hydroxy-2-(hydroxymethyl)oxan-3-yl]oxy}-5-hydroxy-6-(hydroxymethyl)-3-(2-oxopropyl)oxan-4-yl]oxy}-3,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl]oxy}-5-acetamido-4-hydroxy-6-[(1R,2R)-1,2,3-trihydroxypropyl]oxane-2-carboxylic acid > 0.31 > -4.570965198333335 > -3.09 > 1 > 8 > -4 > 2.6118510499809493 > 2.1619347183861306 > -3.9476121977780165 > 965.2000000000007 > 559.7626999999998 > 73 > 0 > 1.97e+00 g/l > (2S,4S,5R)-2-{[(2R,3R,4S,5S,6R)-2-{[(2S,3R,4R,5R,6R)-2-{[(2R,3S,4R,5R,6S)-4-{[(2S,4S,5R)-2-carboxy-6-[(1S,2R)-2-{[(2S,4S,5R)-2-carboxy-6-[(1S,2R)-2-{[(2S,4S,5R)-2-carboxy-5-acetamido-4-hydroxy-6-[(1R,2R)-1,2,3-trihydroxypropyl]oxan-2-yl]oxy}-1,3-dihydroxypropyl]-5-acetamido-4-hydroxyoxan-2-yl]oxy}-1,3-dihydroxypropyl]-5-acetamido-4-hydroxyoxan-2-yl]oxy}-6-{[(2R,3S,4R,5R,6R)-4,5-dihydroxy-6-{[(2S,3R,4E)-3-hydroxy-2-[(11Z)-octadec-11-enamido]octadec-4-en-1-yl]oxy}-2-(hydroxymethyl)oxan-3-yl]oxy}-5-hydroxy-2-(hydroxymethyl)oxan-3-yl]oxy}-5-hydroxy-6-(hydroxymethyl)-3-(2-oxopropyl)oxan-4-yl]oxy}-3,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl]oxy}-5-acetamido-4-hydroxy-6-[(1R,2R)-1,2,3-trihydroxypropyl]oxane-2-carboxylic acid > 0 > BMDB0011951 > Ganglioside GQ1c (d18:1/18:1(11Z)) $$$$