Mol:EEL0024
Copyright: ARM project http://www.metabolome.jp/
55 54 0 0 0 0 0 0 0 0999 V2000 -6.5011 -0.0712 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1228 0.6508 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4476 1.7759 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6921 2.3375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9684 0.4868 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.4621 1.4421 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8249 1.8685 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1103 2.3264 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3963 1.9139 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6821 2.3264 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9676 1.9139 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2533 2.3264 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5388 1.9139 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1754 2.3264 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8900 1.9139 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6043 2.3264 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3187 1.9139 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0330 2.3264 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7473 1.9139 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4615 2.3264 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1760 1.9139 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2141 0.0059 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4999 0.4182 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7856 0.0059 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0714 0.4182 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3571 0.0059 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6426 0.4182 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0716 0.0059 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7862 0.4182 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5005 0.0059 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2151 0.4182 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9293 0.0059 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6435 0.4182 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3577 0.0059 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0723 0.4182 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7866 0.0059 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3963 1.0717 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5388 1.0717 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3187 1.0717 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1760 1.0717 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7856 -0.8364 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0716 -0.8364 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9293 -0.8364 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7866 -0.8364 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8904 2.3265 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5011 0.4183 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3854 2.8474 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.7585 -2.0163 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8762 -2.0224 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 -4.8762 -2.8474 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0512 -2.0224 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8762 -1.1974 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3368 -2.4349 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6223 -2.0224 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9078 -2.4349 0.0000 N 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 6 1 0 2 5 1 0 7 4 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 21 20 1 0 23 22 1 0 24 23 1 0 25 24 1 0 26 25 1 0 27 26 1 0 28 27 1 0 29 28 1 0 30 29 1 0 31 30 1 0 32 31 1 0 33 32 1 0 34 33 1 0 35 34 1 0 36 35 1 0 5 22 1 0 9 37 1 0 13 38 1 0 17 39 1 0 21 40 1 0 24 41 1 0 28 42 1 0 32 43 1 0 36 44 1 0 21 45 1 0 36 46 1 0 47 9 1 0 48 49 1 0 49 50 1 0 49 51 1 0 49 52 2 0 51 53 1 0 53 54 1 0 54 55 1 0 48 1 1 0
S SKP 6 AUTODRAW FALSE ID EEL0024 FORMULA C45H94NO7P EXACTMASS 791.676790877 AVERAGEMASS 792.204161 SMILES OP(=O)(OCCN)OCC(OCCC(CCCC(C)CCCC(CCCC(C)C)C)C)([H])COCCC(CCCC(CCCC(C)CCCC(C)C)C)(C)O M END
