Mol:EEL0128
Copyright: ARM project http://www.metabolome.jp/
167106 0 0 0 0 0 0 0 0999 V2000
-5.6761 -3.4258 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.1933 -2.2709 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8052 -1.5430 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2399 -0.8417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8516 -0.1136 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.0770 -1.9325 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1041 -1.1066 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3041 -1.4995 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1898 0.2686 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6064 0.8520 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3041 -0.7351 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9118 -3.4258 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 -4.9118 -2.6615 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1474 -3.4258 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9118 -4.1902 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.8542 0.6586 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.2890 1.3599 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9008 2.0878 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3355 2.7891 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9266 3.9090 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1725 1.6983 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1996 2.5242 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4329 -3.8383 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7185 -3.4258 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0040 -3.8383 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.8299 3.9167 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 -6.8299 4.6810 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.8299 3.1523 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.6549 3.9167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.2874 5.3186 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9227 6.0402 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3574 6.7414 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9691 7.4696 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.1945 5.6507 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.2216 6.4765 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4216 6.0836 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3073 7.8517 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3073 8.6767 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.4216 6.8480 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5923 -1.9166 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8806 -2.3338 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1688 -2.7509 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4570 -3.1680 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7452 -3.5851 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0334 -4.0023 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6783 -4.4194 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3901 -4.8365 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1019 -5.2536 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8137 -5.6708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5255 -6.0879 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2372 -6.5050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9490 -6.9222 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6608 -7.3393 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3726 -7.7564 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0844 -8.1735 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7961 -8.5907 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6536 -2.8370 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9418 -3.2541 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2300 -3.6712 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5182 -4.0884 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8065 -4.5055 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0947 -4.9226 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6171 -5.3397 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3289 -5.7569 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0407 -6.1740 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7524 -6.5911 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4642 -7.0082 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1760 -7.4254 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8878 -7.8425 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5996 -8.2596 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3113 -8.6767 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3929 0.0551 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5960 -0.1584 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7991 -0.3720 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0022 -0.5855 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2053 -0.7990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4084 -1.0125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3885 -1.2261 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1854 -1.4396 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9822 -1.6531 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7791 -1.8666 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5760 -2.0802 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3729 -2.2937 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1698 -2.5072 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9667 -2.7207 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7636 -2.9343 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5605 -3.1478 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3574 -3.3613 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2079 -0.8486 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4111 -1.0621 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6142 -1.2756 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8173 -1.4891 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0204 -1.7027 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2235 -1.9162 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5734 -2.1297 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3703 -2.3432 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1672 -2.5568 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9641 -2.7703 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7609 -2.9838 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5578 -3.1973 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3547 -3.4109 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1516 -3.6244 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9485 -3.8379 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7098 5.6665 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9981 5.2494 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2863 4.8322 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5745 4.4151 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8627 3.9980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1509 3.5809 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4392 3.1637 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7274 2.7466 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0156 2.3295 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6962 1.9124 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4080 1.4952 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1197 1.0781 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8315 0.6610 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5433 0.2438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2551 -0.1733 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9669 -0.5904 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6786 -1.0075 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7711 4.7461 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0593 4.3290 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3475 3.9119 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6357 3.4948 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9240 3.0776 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2122 2.6605 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5004 2.2434 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7886 1.8263 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0768 1.4091 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6349 0.9920 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3467 0.5749 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0585 0.1578 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7703 -0.2594 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4821 -0.6765 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1938 -1.0936 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4897 7.4320 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6929 7.2184 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8960 7.0049 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0991 6.7914 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3022 6.5779 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5053 6.3643 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7084 6.1508 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9115 5.9373 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1146 5.7238 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6823 5.5102 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4791 5.2967 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2760 5.0832 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0729 4.8697 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8698 4.6561 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6667 4.4426 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4636 4.2291 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2605 4.0156 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3048 6.5283 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5079 6.3148 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7110 6.1013 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9142 5.8877 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1173 5.6742 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3204 5.4607 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5235 5.2472 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7266 5.0336 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0703 4.8201 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8672 4.6066 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6641 4.3931 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4610 4.1795 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2578 3.9660 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0547 3.7525 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8516 3.5390 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 1 0 4 5 1 0 3 7 1 0 3 6 1 0 6 8 1 0 5 9 1 0 9 10 1 0 8 11 2 0 1 12 1 0 12 13 2 0 12 14 1 0 12 15 1 0 16 17 1 0 17 18 1 0 18 19 1 0 19 20 1 0 18 22 1 0 18 21 1 0 9 16 1 0 14 23 1 0 23 24 1 0 24 25 1 0 26 27 2 0 26 28 1 0 26 20 1 0 26 29 1 0 29 30 1 0 31 32 1 0 32 33 1 0 31 35 1 0 31 34 1 0 34 36 1 0 33 37 1 0 37 38 2 0 36 39 2 0 30 31 1 0 8 40 1 0 40 41 3 0 41 42 1 0 42 43 3 0 43 44 1 0 44 45 3 0 45 46 1 0 46 47 3 0 47 48 1 0 48 49 3 0 49 50 1 0 50 51 3 0 51 52 1 0 52 53 3 0 53 54 1 0 54 55 3 0 55 56 1 0 9 72 1 0 72 73 3 0 73 74 1 0 74 75 3 0 75 76 1 0 76 77 3 0 77 78 1 0 78 79 3 0 79 80 1 0 80 81 3 0 81 82 1 0 82 83 3 0 83 84 1 0 84 85 3 0 85 86 1 0 86 87 3 0 87 88 1 0 36104 1 0
104105 3 0 105106 1 0 106107 3 0 107108 1 0 108109 3 0 109110 1 0 110111 3 0 111112 1 0 112113 3 0 113114 1 0 114115 3 0 115116 1 0 116117 3 0 117118 1 0 118119 3 0 119120 1 0
37136 1 0
136137 3 0 137138 1 0 138139 3 0 139140 1 0 140141 3 0 141142 1 0 142143 3 0 143144 1 0 144145 3 0 145146 1 0 146147 3 0 147148 1 0 148149 3 0 149150 1 0 150151 3 0 151152 1 0 M STY 1 1 SUP M SLB 1 1 1 M SAL 1 15 40 41 42 43 44 45 46 47 48 49 50 51 52 53 54 M SAL 1 15 55 56 57 58 59 60 61 62 63 64 65 66 67 68 69 M SAL 1 2 70 71 M SBL 1 1 39 M SMT 1 C17H33 M SBV 1 39 -0.7118 0.4171 M STY 1 2 SUP M SLB 1 2 2 M SAL 2 15 72 73 74 75 76 77 78 79 80 81 82 83 84 85 86 M SAL 2 15 87 88 89 90 91 92 93 94 95 96 97 98 99 100 101 M SAL 2 2 102 103 M SBL 2 1 56 M SMT 2 C17H33 M SBV 2 56 -0.7969 0.2135 M STY 1 3 SUP M SLB 1 3 3 M SAL 3 15 104 105 106 107 108 109 110 111 112 113 114 115 116 117 118 M SAL 3 15 119 120 121 122 123 124 125 126 127 128 129 130 131 132 133 M SAL 3 2 134 135 M SBL 3 1 73 M SMT 3 C17H33 M SBV 3 73 -0.7118 0.4171 M STY 1 4 SUP M SLB 1 4 4 M SAL 4 15 136 137 138 139 140 141 142 143 144 145 146 147 148 149 150 M SAL 4 15 151 152 153 154 155 156 157 158 159 160 161 162 163 164 165 M SAL 4 2 166 167 M SBL 4 1 90 M SMT 4 C17H33 M SBV 4 90 -0.8175 0.4198 S SKP 6 AUTODRAW FALSE ID EEL0128 FORMULA C83H97NO17P2 EXACTMASS 1441.623173703 AVERAGEMASS 1442.6023420000001 SMILES C(=O)(C#CC#CC#CC#CC#CC#CC#CC#CC)OC(COC(OCC([H])(O)COP(O)(=O)OCC(COC(=O)C#CC#CC#CC#CC#CC#CC#CC#CC)([H])OC(=O)C#CC#CC#CC#CC#CC#CC#CC#CC)(C#CC#CC#CC#CC#CC#CC#CC#CC)[H])(COP(O)(=O)OCCN)[H] M END