Mol:EEL1006
Copyright: ARM project http://www.metabolome.jp/
96102 0 0 0 0 0 0 0 0999 V2000 10.3829 -2.8637 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7486 -3.3055 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0342 -2.8933 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3198 -3.3058 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6053 -2.8936 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8910 -3.3061 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9376 -1.6158 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2232 -2.0283 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5087 -1.6161 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7944 -2.0285 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0798 -1.6163 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9039 2.0251 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1896 1.6125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4752 2.0248 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7607 1.6123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0463 2.0246 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0341 -2.0511 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9374 -0.7733 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0797 -0.7739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9037 2.8672 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0462 2.8666 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6379 1.5620 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6379 0.7375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3517 0.3238 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0669 0.7375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0669 1.5620 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7204 -2.0680 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7204 -2.8923 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4342 -3.3060 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1494 -2.8923 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1494 -2.0680 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.3386 2.8605 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7047 3.3028 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9901 2.8910 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2759 3.3040 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5611 2.8922 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8471 3.3052 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8925 1.6169 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1784 2.0298 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4637 1.6181 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7497 2.0310 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0348 1.6193 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8565 -2.0240 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1425 -1.6110 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4278 -2.0228 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7135 -1.6098 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9989 -2.0216 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9893 2.0488 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8918 0.7744 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0341 0.7768 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8558 -2.8661 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9982 -2.8637 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5907 -1.5614 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5912 -0.7369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3053 -0.3237 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0202 -0.7379 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0197 -1.5623 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6756 2.0685 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6761 2.8928 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3901 3.3061 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1051 2.8919 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1046 2.0676 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3207 2.0324 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2848 -1.6085 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3319 1.6120 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3655 -2.0290 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7868 0.3171 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7868 -0.5074 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5006 -0.9211 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2158 -0.5074 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2158 0.3171 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9304 -0.9196 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6447 -0.5068 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4597 -3.0698 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.2532 -2.1758 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3503 -0.4273 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7394 -1.1811 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5528 -1.0012 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.7424 -1.9727 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0549 0.3429 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.1576 -0.3211 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1576 0.5034 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4438 0.9171 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7286 0.5034 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7286 -0.3211 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8724 0.9153 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5866 0.5022 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.8091 1.2155 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.1991 2.2121 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.5406 2.9986 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.6224 1.0915 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -12.3503 0.3942 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.7844 -1.1300 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.3092 1.8718 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.9661 -1.1317 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9569 -1.1317 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2 1 1 0 3 2 1 0 4 3 1 0 5 4 1 0 6 5 1 0 8 7 1 0 9 8 1 0 10 9 1 0 11 10 1 0 13 12 1 0 14 13 1 0 15 14 1 0 16 15 1 0 3 17 1 0 7 18 1 0 11 19 1 0 12 20 1 0 16 21 1 0 22 23 1 0 23 24 1 0 24 25 1 0 25 26 1 0 22 26 1 0 12 22 1 0 27 28 1 0 28 29 1 0 29 30 1 0 30 31 1 0 27 31 1 0 6 30 1 0 7 27 1 0 33 32 1 0 34 33 1 0 35 34 1 0 36 35 1 0 37 36 1 0 39 38 1 0 40 39 1 0 41 40 1 0 42 41 1 0 44 43 1 0 45 44 1 0 46 45 1 0 47 46 1 0 34 48 1 0 38 49 1 0 42 50 1 0 43 51 1 0 47 52 1 0 53 54 1 0 54 55 1 0 55 56 1 0 56 57 1 0 53 57 1 0 43 53 1 0 58 59 1 0 59 60 1 0 60 61 1 0 61 62 1 0 58 62 1 0 37 61 1 0 38 58 1 0 42 63 1 0 47 64 1 0 16 65 1 0 11 66 1 0 64 66 1 0 63 65 1 0 67 68 1 0 68 69 1 0 69 70 1 0 70 71 1 0 67 71 1 0 25 67 1 0 70 72 1 0 72 73 1 0 1 74 1 0 74 75 1 0 76 77 1 0 77 79 1 0 77 78 1 0 76 80 1 0 73 78 1 0 75 77 1 0 81 82 1 0 82 83 1 0 83 84 1 0 84 85 1 0 81 85 1 0 56 85 1 0 82 86 1 0 86 87 1 0 88 89 1 0 89 90 1 0 88 91 1 0 88 92 1 0 92 93 1 0 88 94 1 0 93 95 1 0 32 90 1 0 91 87 1 0 95 96 1 0
A 95 Gal A 96 Glc S SKP 6 AUTODRAW FALSE ID EEL1006 FORMULA C88H164O6 EXACTMASS 1317.25279298 AVERAGEMASS 1318.24016 SMILES C(C41)C(C(C2)CC(C(CCCC(CCC(CCCC(C)C(C7)CC(C7)CCCC(C)CCOCC([H])(OCCC(C3)CCC3C(C6)CC(C6)C(C)CCCC(C)CCC(C)CCCC(C)C(C5)CC(C5)CCCC(CCOCC([H])(OCC4)CO)C)COCC)C)C)C)C2)CC1 M END
