Mol:EEL0158
Copyright: ARM project http://www.metabolome.jp/
106109 0 0 0 0 0 0 0 0999 V2000
-14.6902 -0.6412 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.9967 0.4426 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.3856 1.4398 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.7262 2.2255 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -12.8100 0.2625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -12.9994 1.2341 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.5865 1.9970 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.9522 2.4388 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2379 2.0264 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.5234 2.4388 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8089 2.0264 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0946 2.4388 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3801 2.0264 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6658 2.4388 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9512 2.0264 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2368 2.4388 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5226 2.0264 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8081 2.4388 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0937 2.0264 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3792 2.4388 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6647 2.0264 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.9759 -0.3118 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.3415 0.1180 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.6270 -0.2945 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9127 0.1180 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1983 -0.2945 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4840 0.1180 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4893 -1.6144 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7750 -1.2020 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0605 -1.6144 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3458 -1.2020 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6317 -1.6144 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2379 1.1841 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3801 1.1841 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5226 1.1841 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6647 1.1841 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.6270 -1.1367 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4893 -2.4566 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6317 -2.4566 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9504 2.4389 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9171 -1.2019 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.3125 -2.4427 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.4180 -0.0323 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8896 -0.6624 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7425 -1.9070 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9595 -2.6928 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.6617 0.5487 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.8197 -2.4646 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1855 -2.9065 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4711 -2.4943 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7567 -2.9067 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0422 -2.4945 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3279 -2.9070 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3746 -1.2167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6602 -1.6290 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9456 -1.2169 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2312 -1.6293 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4833 -1.2172 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8274 1.1228 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1931 0.6930 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4786 1.1053 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7643 0.6927 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0499 1.1050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3356 0.6924 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3409 2.4241 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6266 2.0116 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9121 2.4239 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1975 2.0113 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5168 2.4236 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4710 -1.6518 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3744 -0.3742 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4835 -0.3747 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4784 1.9474 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3407 3.2664 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5169 3.2659 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1976 -1.6297 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2313 2.0109 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6830 -1.1314 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6830 -0.3069 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9693 0.1068 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2541 -0.3069 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2541 -1.1314 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0748 1.9610 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0748 1.1367 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7884 0.7230 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5037 1.1367 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5037 1.9610 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1573 -1.6688 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1573 -2.4932 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8709 -2.9069 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5862 -2.4932 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5862 -1.6688 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5627 -0.8976 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.4875 -2.4427 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.4254 -2.4427 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2789 -2.4414 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.4540 -2.4414 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -10.4540 -1.6165 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.4540 -3.2664 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.6290 -2.4414 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.2154 -0.0290 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.0404 -0.0290 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 13.0404 0.7959 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.8653 -0.0290 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.0404 -0.8540 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.6902 -0.0290 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 1 0 2 6 1 0 2 5 1 0 7 4 1 0 8 7 1 0 9 8 1 0 10 9 1 0 11 10 1 0 12 11 1 0 13 12 1 0 14 13 1 0 15 14 1 0 16 15 1 0 17 16 1 0 18 17 1 0 19 18 1 0 20 19 1 0 21 20 1 0 23 22 1 0 24 23 1 0 25 24 1 0 26 25 1 0 27 26 1 0 29 28 1 0 30 29 1 0 31 30 1 0 32 31 1 0 5 22 1 0 9 33 1 0 13 34 1 0 17 35 1 0 21 36 1 0 24 37 1 0 28 38 1 0 32 39 1 0 21 40 1 0 32 41 1 0 1 42 1 0 43 44 1 0 44 45 1 0 45 46 1 0 44 47 1 0 48 46 1 0 49 48 1 0 50 49 1 0 51 50 1 0 52 51 1 0 53 52 1 0 55 54 1 0 56 55 1 0 57 56 1 0 58 57 1 0 60 59 1 0 61 60 1 0 62 61 1 0 63 62 1 0 64 63 1 0 66 65 1 0 67 66 1 0 68 67 1 0 69 68 1 0 47 59 1 0 50 70 1 0 54 71 1 0 58 72 1 0 61 73 1 0 65 74 1 0 69 75 1 0 58 76 1 0 69 77 1 0 40 77 1 0 41 76 1 0 78 79 1 0 79 80 1 0 80 81 1 0 81 82 1 0 78 82 1 0 27 79 1 0 28 82 1 0 83 84 1 0 84 85 1 0 85 86 1 0 86 87 1 0 83 87 1 0 65 83 1 0 64 86 1 0 88 89 1 0 89 90 1 0 90 91 1 0 91 92 1 0 88 92 1 0 53 91 1 0 54 88 1 0 44 93 1 0 42 94 1 0 94 95 1 0 96 97 1 0 97 98 2 0 97 99 2 0 97100 1 0 95 96 1 0
101102 1 0 102103 2 0 102104 1 0 102105 1 0 104106 1 0
43101 1 0
A 94 Gal A 95 Glc A 106 Ino S SKP 6 AUTODRAW FALSE ID EEL0158 FORMULA C89H173O13PS EXACTMASS 1513.2334528220001 AVERAGEMASS 1514.357881 SMILES C(C34)(C)CCCC(C)CCC(C)CCCC(C(C1)CCC(CCCC(CCOC([H])(COCCC(C)CCCC(C)CCCC(C)CCCC(C)CCC(CCCC(C)C(C2)CCC2CCCC(CCOC(COCCC(CCCC(CC4)C3)C)(COP(OC)(O)=O)[H])C)C)COCCOS(O)(=O)=O)C)1)C M END
