Mol:EEL0153
Copyright: ARM project http://www.metabolome.jp/
101108 0 0 0 0 0 0 0 0999 V2000
4.0131 -0.9919 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2987 -1.4044 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5842 -0.9922 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8699 -1.4046 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1553 -0.9924 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9794 2.6488 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2651 2.2362 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5508 2.6485 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8362 2.2360 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1218 2.6483 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0129 -0.1494 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1552 -0.1500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9792 3.4910 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1217 3.4904 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7133 2.1857 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7133 1.3614 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4271 0.9477 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1423 1.3614 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1423 2.1857 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7958 -1.4441 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7958 -2.2684 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5096 -2.6821 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2248 -2.2684 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2248 -1.4441 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.2627 3.4843 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.6289 3.9266 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9143 3.5148 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2002 3.9278 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4854 3.5160 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7714 3.9290 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8169 2.2406 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1028 2.6535 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3881 2.2418 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6740 2.6547 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9592 2.2430 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7809 -1.4001 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0669 -0.9871 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3522 -1.3989 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6378 -0.9859 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9233 -1.3977 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9135 2.6725 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8162 1.3983 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9585 1.4007 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7802 -2.2422 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9226 -2.2398 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5150 -0.9375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5155 -0.1130 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2296 0.3002 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9444 -0.1140 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9439 -0.9384 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5999 2.6922 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6004 3.5166 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3144 3.9299 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0293 3.5157 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0288 2.6913 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2451 2.6561 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2092 -0.9846 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4074 2.2357 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4410 -1.4051 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8622 0.9410 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8622 0.1165 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5760 -0.2972 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2912 0.1165 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2912 0.9410 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0057 -0.2957 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7200 0.1171 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0819 0.3027 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0819 1.1272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3681 1.5409 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6529 1.1272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6529 0.3027 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7967 1.5391 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5108 1.1260 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.7332 1.8394 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.1232 2.8358 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.4647 3.6224 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.5465 1.7154 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -12.2950 0.5437 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.7085 -1.5374 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.2333 2.4955 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.8902 -1.5391 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8810 -1.5391 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9602 -2.6917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9602 -3.5162 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6740 -3.9299 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3892 -3.5162 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3892 -2.6917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3514 -3.9009 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7798 -0.8058 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1571 -2.1019 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2898 -3.1386 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.5659 -0.4609 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.2950 -0.1615 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9947 0.6069 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.2646 -1.4500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0932 -3.1306 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.6988 -1.5420 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.8738 -1.5420 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -7.8738 -0.7171 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.8738 -2.3670 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.0488 -1.5420 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 78 79 1 0 74 80 1 0 79 81 1 0 25 76 1 0 77 73 1 0 81 82 1 0 83 84 1 0 84 85 1 0 85 86 1 0 86 87 1 0 83 87 1 0 23 83 1 0 86 88 1 0 89 90 1 0 90 91 1 0 89 92 1 0 89 93 1 0 93 94 1 0 89 95 1 0 66 92 1 0 88 96 1 0 91 96 1 0 97 98 1 0 98 99 2 0 98100 2 0 98101 1 0 82 97 1 0
A 81 Gal A 82 Glc S SKP 6 AUTODRAW FALSE ID EEL0153 FORMULA C88H162O10S EXACTMASS 1411.1888720939999 AVERAGEMASS 1412.28788 SMILES C(C6)(C)CCCC(C)C(C8)CC(C8)C(C1)CCC1CCOC(COCCOS(O)(=O)=O)([H])COCCC(CCCC(C2)CCC2C(CCCC(CCC(C)CCCC(C)C(C7)CC(C7)C(C3)CCC3CCOC([H])(CO)COCCC(C4)CCC4C(C5)CC(C(C)CCCC(C6)C)C5)C)C)C M END
