Mol:EEL0157
Copyright: ARM project http://www.metabolome.jp/
106108 0 0 0 0 0 0 0 0999 V2000
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0 0 0 0 0 -1.2545 2.1682 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7062 -0.9743 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7062 -0.1498 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9924 0.2639 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2771 -0.1498 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2771 -0.9743 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0514 2.1183 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0514 1.2938 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7652 0.8801 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4805 1.2938 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4805 2.1183 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.5116 -2.6076 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.3433 -2.5986 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.5183 -2.5986 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -10.5183 -1.7737 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.5183 -3.4236 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.6934 -2.5986 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.2384 1.2860 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.0634 1.2860 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 13.0634 2.1109 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.8883 1.2860 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.0634 0.4610 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.7132 1.2860 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 42 43 1 0 44 45 1 0 45 46 1 0 46 47 1 0 45 49 1 0 45 48 1 0 50 47 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 64 63 1 0 66 65 1 0 67 66 1 0 68 67 1 0 69 68 1 0 70 69 1 0 72 71 1 0 73 72 1 0 74 73 1 0 75 74 1 0 48 65 1 0 52 76 1 0 56 77 1 0 60 78 1 0 64 79 1 0 67 80 1 0 71 81 1 0 75 82 1 0 64 83 1 0 75 84 1 0 40 84 1 0 41 83 1 0 85 86 1 0 86 87 1 0 87 88 1 0 88 89 1 0 85 89 1 0 27 86 1 0 28 89 1 0 90 91 1 0 91 92 1 0 92 93 1 0 93 94 1 0 90 94 1 0 71 90 1 0 70 93 1 0 43 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
44101 1 0
A 43 Gal A 95 Glc A 106 Ino S SKP 6 AUTODRAW FALSE ID EEL0157 FORMULA C89H175O13PS EXACTMASS 1515.2491028860002 AVERAGEMASS 1516.3737609999998 SMILES C(C1)CC(C)CCOCC(COCCOS(O)(=O)=O)([H])OCCC(CCCC(C3)CC(C3)C(CCCC(CCC(CCCC(CCCC(CCCC(C)CCOCC(OCCC(C)CCCC(C2)CC(C2)C(CCCC(CCC(CCCC(CCCC1C)C)C)C)C)([H])COP(OC)(O)=O)C)C)C)C)C)C M END