Mol:EEL0172
Copyright: ARM project http://www.metabolome.jp/
116125 0 0 0 0 0 0 0 0999 V2000
3.9099 -1.2231 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1956 -1.6354 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4811 -1.2234 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7669 -1.6357 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0523 -1.2236 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8762 2.4175 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1620 2.0049 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4476 2.4172 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7332 2.0047 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0188 2.4170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9097 -0.3808 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0522 -0.3814 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8760 3.2594 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0187 3.2588 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6100 1.9544 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6100 1.1300 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3238 0.7163 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0389 1.1300 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0389 1.9544 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6925 -1.6751 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6925 -2.4995 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4063 -2.9132 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1213 -2.4995 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1213 -1.6751 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9195 2.0093 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2055 2.4222 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4908 2.0105 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7769 2.4234 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0620 2.0117 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8835 -1.6311 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1696 -1.2183 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4549 -1.6299 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7407 -1.2171 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0261 -1.6288 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9188 1.1669 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0613 1.1693 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8828 -2.4733 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0254 -2.4709 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6175 -1.1687 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6180 -0.3444 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3321 0.0688 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0470 -0.3454 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0465 -1.1696 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7024 2.4608 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7029 3.2850 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4169 3.6982 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1319 3.2841 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1314 2.4598 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3479 2.4248 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3120 -1.2158 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3045 2.0044 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3381 -1.6362 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7588 0.7096 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7588 -0.1149 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4726 -0.5286 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1877 -0.1149 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1877 0.7096 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9021 -0.5271 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6164 -0.1143 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1842 0.0713 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1842 0.8958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4705 1.3095 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7553 0.8958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7553 0.0713 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8989 1.3077 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.6130 0.8946 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8568 -2.9228 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8568 -3.7473 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5706 -4.1610 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2857 -3.7473 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2857 -2.9228 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2478 -4.1320 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6761 -1.0370 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0183 -2.2145 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1861 -3.3697 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.4621 -0.6922 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.2264 0.0414 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1609 -1.6810 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9010 -3.3420 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3215 3.7372 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3215 4.5617 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6078 4.9754 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8926 4.5617 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8926 3.7372 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0363 4.9736 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9252 4.3574 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.7729 1.9233 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.1146 3.1009 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2821 4.2557 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.5591 1.5780 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -12.2264 0.5298 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2575 2.5671 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.9486 -3.7556 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9273 -4.0061 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.6597 -2.2855 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.9486 -4.5629 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9273 -3.0547 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.6597 -3.0547 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6435 -3.7556 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7923 -2.5512 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.6631 -4.9754 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.6435 -4.5806 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.9486 -3.0677 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.7921 -1.7263 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.1023 -4.0061 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7182 1.5816 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.9035 1.5871 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 10.9035 2.4120 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.9035 0.7621 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.0785 1.5871 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.2535 1.5871 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9277 -4.0155 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1029 -4.0155 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -5.1029 -3.1906 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1029 -4.8405 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2779 -4.0155 0.0000 O 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 7 6 1 0 8 7 1 0 9 8 1 0 10 9 1 0 1 11 1 0 5 12 1 0 6 13 1 0 10 14 1 0 15 16 1 0 16 17 1 0 17 18 1 0 18 19 1 0 15 19 1 0 6 15 1 0 20 21 1 0 21 22 1 0 22 23 1 0 23 24 1 0 20 24 1 0 1 20 1 0 26 25 1 0 27 26 1 0 28 27 1 0 29 28 1 0 31 30 1 0 32 31 1 0 33 32 1 0 34 33 1 0 25 35 1 0 29 36 1 0 30 37 1 0 34 38 1 0 39 40 1 0 40 41 1 0 41 42 1 0 42 43 1 0 39 43 1 0 30 39 1 0 44 45 1 0 45 46 1 0 46 47 1 0 47 48 1 0 44 48 1 0 25 44 1 0 29 49 1 0 34 50 1 0 10 51 1 0 5 52 1 0 50 52 1 0 49 51 1 0 53 54 1 0 54 55 1 0 55 56 1 0 56 57 1 0 53 57 1 0 18 53 1 0 56 58 1 0 58 59 1 0 60 61 1 0 61 62 1 0 62 63 1 0 63 64 1 0 60 64 1 0 42 64 1 0 61 65 1 0 65 66 1 0 67 68 1 0 68 69 1 0 69 70 1 0 70 71 1 0 67 71 1 0 23 67 1 0 70 72 1 0 73 74 1 0 74 75 1 0 73 76 1 0 73 77 1 0 73 78 1 0 59 76 1 0 72 79 1 0 75 79 1 0 80 81 1 0 81 82 1 0 82 83 1 0 83 84 1 0 80 84 1 0 47 84 1 0 81 85 1 0 85 86 1 0 87 88 1 0 88 89 1 0 87 90 1 0 87 91 1 0 87 92 1 0 90 66 1 0 89 86 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 91 1 0
106107 1 0 107108 2 0 107109 1 0 107110 1 0 110111 1 0
77106 1 0
112113 1 0 113114 2 0 113115 2 0 113116 1 0 105112 1 0 A 105 Glc A 111 Ino S SKP 6 AUTODRAW FALSE ID EEL0172 FORMULA C94H171O18PS EXACTMASS 1651.192375868 AVERAGEMASS 1652.3925009999998 SMILES C(C67)(C1)CC(C(C)CCCC(C)CCC(C)CCCC(C(C%10)CC(C%10)C(C2)CC(CCOC(COCCC(C3)CCC3C(C4)CCC4C(CCCC(CCC(CCCC(C(C9)CC(C9)C(C5)CCC(CCOC(COC(C(CO)8O)C(O)C(C8O)OCOS(O)(=O)=O)(COCCC(C7)CC6)[H])5)C)C)C)C)(COP(O)(=O)OC)[H])C2)C)C1 M END
