Mol:EEL1025
Copyright: ARM project http://www.metabolome.jp/
111113 0 0 0 0 0 0 0 0999 V2000
-15.1495 0.1792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.4734 1.2420 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.5720 2.4892 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.5015 3.3136 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -13.2727 0.4431 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -12.3617 3.0852 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.7275 3.5268 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.0133 3.1146 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.2989 3.5268 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5843 3.1146 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8699 3.5268 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1555 3.1146 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4411 3.5268 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7264 3.1146 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0121 3.5268 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2978 3.1146 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5834 3.5268 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8691 3.1146 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1546 3.5268 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4400 3.1146 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.5349 -0.4200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.9006 0.0098 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.1862 -0.4026 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.4718 0.0098 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7573 -0.4026 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0430 0.0098 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2646 -0.5263 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5503 -0.1139 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8359 -0.5263 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1213 -0.1139 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4070 -0.5263 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.0133 2.2722 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1555 2.2722 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2978 2.2722 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4400 2.2722 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.1862 -1.2449 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2646 -1.3686 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4070 -1.3686 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7257 3.5269 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6924 -0.1138 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6838 2.2108 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0729 1.4570 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4620 0.4598 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8029 -0.3261 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.8862 1.6368 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.0758 0.6654 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6630 -0.0979 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0288 -0.5397 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3145 -0.1275 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6002 -0.5400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8855 -0.1278 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1712 -0.5402 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4567 -0.1280 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7424 -0.5405 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0278 -0.1283 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3134 -0.5408 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5991 -0.1286 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8847 -0.5410 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1703 -0.1288 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4559 -0.5413 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2587 -0.1291 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0520 2.2109 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4178 1.7811 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7033 2.1934 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9890 1.7808 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2744 2.1931 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5602 1.7806 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5655 3.5121 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8512 3.0997 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1367 3.5120 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4221 3.0994 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2922 3.5116 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3144 0.7151 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4565 0.7145 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5990 0.7140 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2589 0.7135 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7031 3.0356 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5653 4.3545 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2924 4.3540 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9730 -0.5416 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0067 3.0991 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2422 -1.2396 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2422 -0.4151 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0293 -0.0433 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2992 3.0492 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2992 2.2248 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0130 1.8111 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7283 2.2248 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7283 3.0492 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5352 0.0102 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7595 -0.4271 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.7007 1.5314 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.7007 -3.1347 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.6792 -3.3852 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -14.4118 -1.6644 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -13.7007 -3.9420 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.6792 -2.4337 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.4118 -2.4337 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.3954 -3.1347 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.5443 -1.9301 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.4152 -4.3545 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.3954 -3.9597 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -13.7007 -2.4467 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -12.5441 -1.1052 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.9648 -3.7977 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3244 2.2424 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.5096 2.2479 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 13.5096 3.0728 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.5096 1.4229 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.6846 2.2479 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.1495 2.2424 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 1 0 2 5 1 0 6 4 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 16 15 1 0 17 16 1 0 18 17 1 0 19 18 1 0 20 19 1 0 22 21 1 0 23 22 1 0 24 23 1 0 25 24 1 0 26 25 1 0 28 27 1 0 29 28 1 0 30 29 1 0 31 30 1 0 5 21 1 0 8 32 1 0 12 33 1 0 16 34 1 0 20 35 1 0 23 36 1 0 27 37 1 0 31 38 1 0 20 39 1 0 31 40 1 0 41 42 1 0 42 43 1 0 43 44 1 0 42 46 1 0 42 45 1 0 47 44 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 55 54 1 0 56 55 1 0 57 56 1 0 58 57 1 0 59 58 1 0 60 59 1 0 61 60 1 0 63 62 1 0 64 63 1 0 65 64 1 0 66 65 1 0 67 66 1 0 69 68 1 0 70 69 1 0 71 70 1 0 72 71 1 0 45 62 1 0 49 73 1 0 53 74 1 0 57 75 1 0 61 76 1 0 64 77 1 0 68 78 1 0 72 79 1 0 61 80 1 0 72 81 1 0 39 81 1 0 40 80 1 0 82 83 1 0 26 83 1 0 27 84 1 0 85 86 1 0 86 87 1 0 87 88 1 0 88 89 1 0 85 89 1 0 68 85 1 0 67 88 1 0 83 90 1 0 84 91 1 0 91 90 1 0 2 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 95 1 1 0
100104 1 0
94105 1 0
106107 1 0 107108 2 0 107109 1 0 107110 1 0 106111 1 0 110 41 1 0 A 105 Glc A 111 Ino S SKP 6 AUTODRAW FALSE ID EEL1025 FORMULA C94H185O14P EXACTMASS 1569.3501971379999 AVERAGEMASS 1570.440061 SMILES O(P(OC)(O)=O)CC(C2)(OCCC(C)CCCC(C3)CC(C3)C(CCCC(CCC(C)CCCC(C)CCCC(C)CCCC(CCOCC([H])(OCCC(CCCC(C)CCCC(CCCC(CCC(C)CCCC(CCCC(CCCC(C)CCO2)C)C)C)C)C)COC(C(O)1)C(O)(CO)C(O)C1OC)C)C)C)[H] M END
