Mol:EEL1041
Copyright: ARM project http://www.metabolome.jp/
95 96 0 0 0 0 0 0 0 0999 V2000 -13.4166 -1.2107 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.7405 -0.1480 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.8391 1.0993 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.7688 1.9237 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.5400 -0.9468 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.6289 1.6953 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9947 2.1369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2805 1.7247 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5661 2.1369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8515 1.7247 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1371 2.1369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4227 1.7247 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7083 2.1369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9937 1.7247 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2793 2.1369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5650 1.7247 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8506 2.1369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1363 1.7247 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4218 2.1369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7072 1.7247 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.8021 -1.8099 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.1678 -1.3801 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.4534 -1.7925 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7390 -1.3801 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0245 -1.7925 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3102 -1.3801 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5318 -1.9162 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8175 -1.5038 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1031 -1.9162 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3885 -1.5038 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6742 -1.9162 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2805 0.8823 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4227 0.8823 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5650 0.8823 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7072 0.8823 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.4534 -2.6348 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5318 -2.7585 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6742 -2.7585 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0071 2.1370 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0404 -1.5037 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.7263 -2.9645 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.7717 -2.9566 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4166 0.8209 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8057 0.0670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1948 -0.9301 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5357 -1.7160 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6191 0.2469 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.8087 -0.7246 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3959 -1.4878 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7616 -1.9296 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0473 -1.5174 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3330 -1.9299 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6183 -1.5177 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9040 -1.9301 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1895 -1.5179 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4752 -1.9304 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7606 -1.5182 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0463 -1.9307 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3319 -1.5185 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6175 -1.9309 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9031 -1.5187 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1887 -1.9312 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4741 -1.5190 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7848 0.8210 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1506 0.3912 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4361 0.8035 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7218 0.3909 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0072 0.8032 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2930 0.3907 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2983 2.1222 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5840 1.7098 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8695 2.1221 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1549 1.7095 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4406 2.1217 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0472 -0.6749 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1893 -0.6755 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3318 -0.6760 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4739 -0.6765 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4359 1.6457 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2981 2.9645 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4404 2.9640 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7598 -1.9315 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7261 1.7092 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1212 1.5911 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.5094 -2.6295 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5094 -1.8050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2965 -1.4332 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0321 1.6593 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0321 0.8349 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7458 0.4212 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4611 0.8349 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4611 1.6593 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8024 -1.3797 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0268 -1.8170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.9679 0.1414 0.0000 H 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 5 1 0 6 4 1 0 7 6 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 22 21 1 0 23 22 1 0 24 23 1 0 25 24 1 0 26 25 1 0 28 27 1 0 29 28 1 0 30 29 1 0 31 30 1 0 5 21 1 0 8 32 1 0 12 33 1 0 16 34 1 0 20 35 1 0 23 36 1 0 27 37 1 0 31 38 1 0 20 39 1 0 31 40 1 0 1 41 1 0 41 42 1 0 43 44 1 0 44 45 1 0 45 46 1 0 44 48 1 0 44 47 1 0 49 46 1 0 50 49 1 0 51 50 1 0 52 51 1 0 53 52 1 0 54 53 1 0 55 54 1 0 56 55 1 0 57 56 1 0 58 57 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 69 68 1 0 71 70 1 0 72 71 1 0 73 72 1 0 74 73 1 0 47 64 1 0 51 75 1 0 55 76 1 0 59 77 1 0 63 78 1 0 66 79 1 0 70 80 1 0 74 81 1 0 63 82 1 0 74 83 1 0 43 84 1 0 39 83 1 0 40 82 1 0 85 86 1 0 26 86 1 0 27 87 1 0 88 89 1 0 89 90 1 0 90 91 1 0 91 92 1 0 88 92 1 0 70 88 1 0 69 91 1 0 86 93 1 0 87 94 1 0 94 93 1 0 2 95 1 0
A 42 Glc S SKP 6 AUTODRAW FALSE ID EEL1041 FORMULA C87H172O6 EXACTMASS 1313.315393236 AVERAGEMASS 1314.2929800000002 SMILES C(O2)([H])(COC)COCCC(C)CCCC(C)CCCC(C)CCCC(C)CCC(CCCC(C)C(C1)CC(CCCC(CCOC(CO)(COCCC(C)CCCC(C)CCCC(CCCC(CCC(CCCC(C)CCCC(C)CCCC(CC2)C)C)C)C)[H])C)C1)C M END
