Mol:EEL0171
Copyright: ARM project http://www.metabolome.jp/
116124 0 0 0 0 0 0 0 0999 V2000
3.9918 -0.4309 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2774 -0.8433 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5629 -0.4312 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8486 -0.8435 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1341 -0.4314 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9581 3.2097 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2438 2.7971 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5294 3.2094 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8149 2.7969 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1006 3.2092 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9916 0.4116 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1340 0.4110 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9579 4.0518 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1005 4.0512 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6919 2.7466 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6919 1.9223 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4057 1.5086 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1207 1.9223 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1207 2.7466 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7744 -0.8830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7744 -1.7073 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4882 -2.1210 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2032 -1.7073 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2032 -0.8830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.2834 4.0451 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.6496 4.4874 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9350 4.0756 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2209 4.4886 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5062 4.0768 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7923 4.4898 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8378 2.8015 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1238 3.2144 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4092 2.8027 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6952 3.2156 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9803 2.8039 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8018 -0.8390 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0879 -0.4261 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3733 -0.8378 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6590 -0.4249 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9444 -0.8366 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9342 3.2334 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8371 1.9592 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9796 1.9616 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8011 -1.6811 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9437 -1.6787 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5359 -0.3765 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5364 0.4480 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2505 0.8612 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9654 0.4470 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9649 -0.3774 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6208 3.2531 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6213 4.0774 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3353 4.4907 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0503 4.0765 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0498 3.2522 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2662 3.2170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2303 -0.4236 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3863 2.7966 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4199 -0.8440 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8407 1.5019 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8407 0.6775 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5545 0.2638 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2697 0.6775 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2697 1.5019 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9841 0.2653 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6984 0.6781 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1026 0.8637 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1026 1.6881 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3889 2.1018 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6738 1.6881 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6738 0.8637 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8174 2.1000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5315 1.6869 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.7538 2.4003 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.1437 3.3967 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.4853 4.1832 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.5672 2.2763 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -12.2743 1.0015 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2539 3.0564 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9387 -2.1306 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9387 -2.9550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6525 -3.3687 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3677 -2.9550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3677 -2.1306 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3298 -3.3397 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7581 -0.2448 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1354 -1.5408 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2681 -2.5775 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.5441 0.1001 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.2743 0.7942 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2429 -0.8889 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0715 -2.5695 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.8188 -3.2710 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7974 -3.5215 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.5298 -1.8009 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.8188 -4.0782 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7974 -2.5700 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.5298 -2.5700 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5135 -3.2710 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.6624 -2.0665 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.5332 -4.4907 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.5135 -4.0959 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.8188 -2.5830 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.6622 -1.2416 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.9724 -3.5215 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6287 2.1694 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.8139 2.1749 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 10.8139 2.9998 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.8139 1.3500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.9890 2.1749 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.1640 2.1749 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8041 -3.5397 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9792 -3.5397 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.9792 -2.7149 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9792 -4.3647 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1543 -3.5397 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 30 29 1 0 32 31 1 0 33 32 1 0 34 33 1 0 35 34 1 0 37 36 1 0 38 37 1 0 39 38 1 0 40 39 1 0 27 41 1 0 31 42 1 0 35 43 1 0 36 44 1 0 40 45 1 0 46 47 1 0 47 48 1 0 48 49 1 0 49 50 1 0 46 50 1 0 36 46 1 0 51 52 1 0 52 53 1 0 53 54 1 0 54 55 1 0 51 55 1 0 30 54 1 0 31 51 1 0 35 56 1 0 40 57 1 0 10 58 1 0 5 59 1 0 57 59 1 0 56 58 1 0 60 61 1 0 61 62 1 0 62 63 1 0 63 64 1 0 60 64 1 0 18 60 1 0 63 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 49 71 1 0 68 72 1 0 72 73 1 0 74 75 1 0 75 76 1 0 74 77 1 0 74 78 1 0 74 79 1 0 25 76 1 0 77 73 1 0 80 81 1 0 81 82 1 0 82 83 1 0 83 84 1 0 80 84 1 0 23 80 1 0 83 85 1 0 86 87 1 0 87 88 1 0 86 89 1 0 86 90 1 0 86 91 1 0 66 89 1 0 85 92 1 0 88 92 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 78 1 0
106107 1 0 107108 2 0 107109 1 0 107110 1 0 110111 1 0
90106 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 EEL0171 FORMULA C94H173O18PS EXACTMASS 1653.208025932 AVERAGEMASS 1654.408381 SMILES C(C71)CC(C(C2)CCC2CCOCC(COP(O)(=O)OC)([H])OCCC(C3)CCC(C(C4)CCC4C(C)CCCC(C)CCC(CCCC(C)C(C5)CCC5CCCC(CCOCC(COC(C9(O)CO)C(C(C(O)9)OCOS(O)(=O)=O)O)([H])OCCC(C6)CC(C(C8)CC(C8)C(C)CCCC(CCC(CCCC(C)7)C)C)C6)C)C)3)C1 M END
