Mol:EEL1027
Copyright: ARM project http://www.metabolome.jp/
111115 0 0 0 0 0 0 0 0999 V2000
-13.2053 0.2668 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.5943 1.0206 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.9832 2.0178 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.3238 2.8036 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.4076 0.8405 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.5970 1.8121 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.1841 2.5751 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.5498 3.0169 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8355 2.6045 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1210 3.0169 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4065 2.6045 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6922 3.0169 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9777 2.6045 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2634 3.0169 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5488 2.6045 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8344 3.0169 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1202 2.6045 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4057 3.0169 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6913 2.6045 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9768 3.0169 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2623 2.6045 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.5735 0.2662 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9391 0.6960 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2246 0.2835 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5103 0.6960 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7959 0.2835 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0816 0.6960 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0869 -1.0364 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3726 -0.6239 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6581 -1.0364 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9434 -0.6239 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2293 -1.0364 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8355 1.7621 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9777 1.7621 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1202 1.7621 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2623 1.7621 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2246 -0.5586 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0869 -1.8786 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2293 -1.8786 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5480 3.0170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5147 -0.6238 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2053 0.9903 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2919 -0.0844 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1448 -1.3290 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3618 -2.1148 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.0640 1.1267 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.2220 -1.8866 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5878 -2.3285 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8734 -1.9163 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1590 -2.3287 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4445 -1.9165 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7302 -2.3290 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7769 -0.6386 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0625 -1.0510 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3479 -0.6388 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6335 -1.0513 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9190 -0.6391 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2297 1.7008 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5954 1.2710 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8809 1.6833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1666 1.2707 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4522 1.6830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7379 1.2704 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7432 3.0022 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0289 2.5897 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3144 3.0020 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5998 2.5894 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8855 3.0017 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8733 -1.0738 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7767 0.2038 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9188 0.2033 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8807 2.5255 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7430 3.8444 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8854 3.8439 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2047 -1.0517 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1710 2.5890 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2806 -0.5533 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2806 0.2711 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5669 0.6848 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8517 0.2711 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8517 -0.5533 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4771 2.5391 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4771 1.7147 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1907 1.3010 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9060 1.7147 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9060 2.5391 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5596 -1.0908 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5596 -1.9152 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2732 -2.3289 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9885 -1.9152 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9885 -1.0908 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9650 -0.3195 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.6125 -2.6247 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5911 -2.8752 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -12.3235 -1.1544 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.6125 -3.4319 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5911 -1.9237 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.3235 -1.9237 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3072 -2.6247 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.4561 -1.4201 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.3269 -3.8444 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.3072 -3.4496 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.6125 -1.9367 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.4559 -0.5951 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.8767 -3.2876 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6147 2.8056 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.7999 2.8111 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 11.7999 3.6360 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.7999 1.9861 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.9749 2.8111 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.1499 2.8111 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 42 43 1 0 43 44 1 0 44 45 1 0 43 46 1 0 47 45 1 0 48 47 1 0 49 48 1 0 50 49 1 0 51 50 1 0 52 51 1 0 54 53 1 0 55 54 1 0 56 55 1 0 57 56 1 0 59 58 1 0 60 59 1 0 61 60 1 0 62 61 1 0 63 62 1 0 65 64 1 0 66 65 1 0 67 66 1 0 68 67 1 0 46 58 1 0 49 69 1 0 53 70 1 0 57 71 1 0 60 72 1 0 64 73 1 0 68 74 1 0 57 75 1 0 68 76 1 0 40 76 1 0 41 75 1 0 77 78 1 0 78 79 1 0 79 80 1 0 80 81 1 0 77 81 1 0 27 78 1 0 28 81 1 0 82 83 1 0 83 84 1 0 84 85 1 0 85 86 1 0 82 86 1 0 64 82 1 0 63 85 1 0 87 88 1 0 88 89 1 0 89 90 1 0 90 91 1 0 87 91 1 0 52 90 1 0 53 87 1 0 43 92 1 0 99 93 1 1 98 93 1 1 97 99 1 1 97 94 1 0 98 95 1 0 93 96 1 0
100 97 1 0
98100 1 0 96101 1 0 99102 1 0 93103 1 0
100104 1 0
94105 1 0 95 1 1 0
106107 1 0 107108 2 0 107109 1 0 107110 1 0 110111 1 0
42106 1 0
A 105 Glc A 111 Ino S SKP 6 AUTODRAW FALSE ID EEL1027 FORMULA C94H181O14P EXACTMASS 1565.31889701 AVERAGEMASS 1566.408301 SMILES C(O4)CC(C)CCCC(C1)CC(C(C)CCCC(C)CCC(C)CCCC(C)C(C2)CCC2CCCC(CCOC([H])(COCCC(C)CCCC(C)CCCC(C)CCCC(CCC(CCCC(C(C5)CC(C5)CCCC(CCOC(COP(OC)(O)=O)([H])C4)C)C)C)C)COC(C3(O)CO)C(C(C(O)3)OC)O)C)C1 M END
