Mol:EEL3007
Copyright: ARM project http://www.metabolome.jp/
105106 0 0 0 0 0 0 0 0999 V2000
-11.4553 2.6791 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.5460 3.1758 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8320 2.7635 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1176 3.1758 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4030 2.7635 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6886 3.1758 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9744 2.7635 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2600 3.1758 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5454 2.7635 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8310 3.1758 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1167 2.7635 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4022 3.1758 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6881 2.7635 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9737 3.1758 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2591 2.7635 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.5835 0.4665 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9493 0.8963 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2349 0.4839 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5205 0.8963 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8060 0.4839 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0918 0.8963 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3137 0.3602 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5993 0.7726 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8850 0.3602 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1704 0.7726 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4561 0.3602 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8320 1.9212 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9744 1.9212 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1167 1.9212 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2591 1.9212 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2349 -0.1018 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3137 -0.4821 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4561 -0.4821 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5448 3.1759 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2585 0.7727 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0231 2.3433 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4122 1.3463 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7531 0.5604 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.8366 2.5232 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.6134 0.7886 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9791 0.3468 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2647 0.7590 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5506 0.3465 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8359 0.7587 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1216 0.3463 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4073 0.7585 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6930 0.3460 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9784 0.7582 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2641 0.3457 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5497 0.7579 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8353 0.3455 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1210 0.7577 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4067 0.3452 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6921 0.7574 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0023 3.0973 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3680 2.6675 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6537 3.0798 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9394 2.6672 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2248 3.0795 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5108 2.6670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7461 3.1611 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0320 2.7486 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3175 3.1609 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6029 2.7483 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8886 3.1606 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2646 1.6015 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4071 1.6009 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5496 1.6004 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6919 1.5999 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6535 3.9220 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7459 4.0034 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8884 4.0029 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9778 0.3449 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1741 2.7480 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2911 -0.3531 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2911 0.4714 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0782 0.8432 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4799 2.6981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9636 2.6975 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6789 3.1112 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5841 0.8967 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8085 0.4594 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2488 3.1095 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6649 3.9361 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.9238 1.0147 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.3138 2.0113 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.6553 2.7978 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.7372 0.8907 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -13.5384 0.2022 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5384 2.9876 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2380 3.7560 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.5079 1.6991 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.4240 1.6709 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.1751 -2.7837 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.8861 -1.3134 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -12.1751 -3.5909 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1538 -2.0827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.8861 -2.0827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8700 -2.7837 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.0187 -1.5791 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.8895 -4.0034 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.8700 -3.6086 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -12.1751 -2.0957 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.0185 -0.7542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.1538 -2.9077 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 6 5 1 0 7 6 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 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 3 27 1 0 7 28 1 0 11 29 1 0 15 30 1 0 18 31 1 0 22 32 1 0 26 33 1 0 15 34 1 0 26 35 1 0 36 37 1 0 37 38 1 0 36 39 1 0 40 38 1 0 41 40 1 0 42 41 1 0 43 42 1 0 44 43 1 0 45 44 1 0 46 45 1 0 47 46 1 0 48 47 1 0 49 48 1 0 50 49 1 0 51 50 1 0 52 51 1 0 53 52 1 0 54 53 1 0 56 55 1 0 57 56 1 0 58 57 1 0 59 58 1 0 60 59 1 0 62 61 1 0 63 62 1 0 64 63 1 0 65 64 1 0 39 55 1 0 42 66 1 0 46 67 1 0 50 68 1 0 54 69 1 0 57 70 1 0 61 71 1 0 65 72 1 0 54 73 1 0 65 74 1 0 34 74 1 0 35 73 1 0 75 76 1 0 21 76 1 0 22 77 1 0 79 80 1 0 61 78 1 0 60 80 1 0 76 81 1 0 77 82 1 0 82 81 1 0 79 83 1 0 83 78 1 0 80 84 1 0 85 86 1 0 86 87 1 0 85 88 1 0 16 88 1 0 1 87 1 0 85 89 1 0 36 90 1 0 90 91 1 0 36 92 1 0 85 93 1 0 99 94 1 1 98 94 1 1 97 99 1 1 98 95 1 0 94 96 1 0
100 97 1 0
98100 1 0 96101 1 0 99102 1 0 94103 1 0
100104 1 0
95 89 1 0 97105 1 0
S SKP 6 AUTODRAW FALSE ID EEL3007 FORMULA C92H182O11 EXACTMASS 1463.368216666 AVERAGEMASS 1464.42288 SMILES C(C1)C(CCCC(C)CCCC(C)CCC(CCCC(C)CCCC(CCCC(CCOC(COC(C(CO)(O)2)C(O)C(O)C(O)2)(COCCC(C)CCCC(CCCC(CCCC(CCC(CCCC(C)CCCC(CCCC(CCOC(CO)([H])COCCC(C)C1)C)C)C)C)C)C)[H])C)C)C)C M END
