Mol:EEL3030
Copyright: ARM project http://www.metabolome.jp/
104104 0 0 0 0 0 0 0 0999 V2000
11.0104 1.3381 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.8353 1.3381 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 11.8353 2.1631 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.6605 1.3381 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.8353 0.5131 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -14.9989 -2.5756 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -15.4681 -1.8188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.0492 -1.0330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.5184 -0.2761 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -15.0993 0.5096 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -14.2632 -1.4535 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -14.2924 -0.5620 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.0397 0.9220 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.3253 0.5096 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.6111 0.9220 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.8967 0.5096 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.1822 0.9220 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.4677 0.5096 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7534 0.9220 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0391 0.5096 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3246 0.9220 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6101 0.5096 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8958 0.9220 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1815 0.5096 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4673 0.9220 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7526 0.5096 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0383 0.9220 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3237 0.5096 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.4290 -0.9861 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.7146 -1.3986 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.0004 -0.9861 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2860 -1.3986 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.5715 -0.9861 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8573 -1.3986 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1430 -0.9861 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4284 -1.3986 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7139 -0.9861 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9995 -1.3986 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2851 -0.9861 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5711 -1.3986 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8565 -0.9861 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1420 -1.3986 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4275 -0.9861 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.6111 1.7645 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7534 1.7645 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8958 1.7645 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.0004 -0.1438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1430 -0.1438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2851 -0.1438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4275 -0.1438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1397 1.3412 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7211 0.5554 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1899 -0.2015 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7713 -0.9873 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9351 0.9759 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9642 0.0845 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7117 -1.3998 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9971 -0.9873 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2828 -1.3998 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5685 -0.9873 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8542 -1.3998 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1397 -0.9873 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4252 -1.3998 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7109 -0.9873 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9965 -1.3998 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2821 -0.9873 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5677 -1.3998 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8533 -0.9873 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1389 -1.3998 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5754 -0.9873 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2898 -1.3998 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8152 -1.3967 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1008 0.5085 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3863 0.9210 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6721 0.5085 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9580 0.9210 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2436 0.5085 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5290 0.9210 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8146 0.5085 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1004 0.9210 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3859 0.5085 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6713 0.9210 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9569 0.5085 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2428 0.9210 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4716 0.5085 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1861 0.9210 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9007 0.5085 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2828 -2.2421 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4252 -2.2421 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5677 -2.2421 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2898 -2.2421 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6721 -0.3336 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8146 -0.3336 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9569 -0.3336 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9007 -0.3336 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6095 0.9221 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1009 -0.9842 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0383 1.7470 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3748 1.7506 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0893 1.3381 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.8038 1.7506 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.8038 2.5756 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.5184 1.3381 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.0893 0.5131 0.0000 N 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 2 5 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 8 12 1 0 0 0 0 8 11 1 0 0 0 0 13 10 1 0 0 0 0 14 13 1 0 0 0 0 15 14 1 0 0 0 0 16 15 1 0 0 0 0 17 16 1 0 0 0 0 18 17 1 0 0 0 0 19 18 1 0 0 0 0 20 19 1 0 0 0 0 21 20 1 0 0 0 0 22 21 1 0 0 0 0 23 22 1 0 0 0 0 24 23 1 0 0 0 0 25 24 1 0 0 0 0 26 25 1 0 0 0 0 27 26 1 0 0 0 0 28 27 1 0 0 0 0 30 29 1 0 0 0 0 31 30 1 0 0 0 0 32 31 1 0 0 0 0 33 32 1 0 0 0 0 34 33 1 0 0 0 0 35 34 1 0 0 0 0 36 35 1 0 0 0 0 37 36 1 0 0 0 0 38 37 1 0 0 0 0 39 38 1 0 0 0 0 40 39 1 0 0 0 0 41 40 1 0 0 0 0 42 41 1 0 0 0 0 43 42 1 0 0 0 0 11 29 1 0 0 0 0 15 44 1 0 0 0 0 19 45 1 0 0 0 0 23 46 1 0 0 0 0 31 47 1 0 0 0 0 35 48 1 0 0 0 0 39 49 1 0 0 0 0 43 50 1 0 0 0 0 51 52 1 0 0 0 0 52 53 1 0 0 0 0 53 54 1 0 0 0 0 52 56 1 0 0 0 0 52 55 1 0 0 0 0 57 54 1 0 0 0 0 58 57 1 0 0 0 0 59 58 1 0 0 0 0 60 59 1 0 0 0 0 61 60 1 0 0 0 0 62 61 1 0 0 0 0 63 62 1 0 0 0 0 64 63 1 0 0 0 0 65 64 1 0 0 0 0 66 65 1 0 0 0 0 67 66 1 0 0 0 0 68 67 1 0 0 0 0 69 68 1 0 0 0 0 70 69 1 0 0 0 0 71 70 1 0 0 0 0 74 73 1 0 0 0 0 75 74 1 0 0 0 0 76 75 1 0 0 0 0 77 76 1 0 0 0 0 78 77 1 0 0 0 0 79 78 1 0 0 0 0 80 79 1 0 0 0 0 81 80 1 0 0 0 0 82 81 1 0 0 0 0 83 82 1 0 0 0 0 84 83 1 0 0 0 0 85 84 1 0 0 0 0 86 85 1 0 0 0 0 87 86 1 0 0 0 0 55 73 1 0 0 0 0 59 88 1 0 0 0 0 63 89 1 0 0 0 0 67 90 1 0 0 0 0 71 91 1 0 0 0 0 75 92 1 0 0 0 0 79 93 1 0 0 0 0 83 94 1 0 0 0 0 87 95 1 0 0 0 0 43 72 1 0 0 0 0 28 96 1 0 0 0 0 72 97 1 0 0 0 0 87 96 1 0 0 0 0 71 97 1 0 0 0 0 51 1 1 0 0 0 0 27 98 1 0 0 0 0 4 99 1 0 0 0 0 99100 1 0 0 0 0
100101 1 0 0 0 0 101102 2 0 0 0 0 101103 1 0 0 0 0 100104 1 0 0 0 0 S SKP 6 AUTODRAW FALSE ID EEL3030 FORMULA C89H178NO11P EXACTMASS 1468.313752053 AVERAGEMASS 1469.339521 SMILES C(C1)C(CCCC(C)CCCC(C)CCC(CCCC(CCCC(CCCC(CCOC([H])(COCCC(C)CCCC(CCCC(C)CCCC(C)CCC(CCCC(CCCC(C)CCCC(C)CCOC(COCCC(C1)C)([H])CO)C)C)C)COP(O)(=O)OCC(N)C(O)=O)C)C)C)C)C M END
