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<p></p> <p><b>New page</b></p><div>&lt;pre&gt;<br /> <br /> Copyright: ARM project http://www.metabolome.jp/<br /> 51 53 0 0 1 0 0 0 0 0999 V2000<br /> 2.9781 -3.8348 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 3.2872 -4.7859 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 2.0000 -3.6269 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> 20.3353 -2.8049 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0<br /> 19.4692 -2.3049 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 19.4692 -1.3049 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0<br /> 20.3353 -0.8049 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 21.2013 -1.3049 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 21.2013 -2.3049 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 21.9444 -0.6358 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0<br /> 21.5377 0.2778 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 20.5432 0.1733 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0<br /> 22.0673 -2.8049 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0<br /> 19.8740 0.9164 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0<br /> 20.0820 1.8946 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0<br /> 19.2159 2.3946 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0<br /> 18.4728 1.7254 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0<br /> 17.4946 1.9333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 20.9955 2.3013 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> 19.1114 3.3891 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> 18.8795 0.8119 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> 16.8255 1.1902 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> 19.9204 3.9769 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0<br /> 20.5082 3.1678 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> 20.7294 4.5646 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> 19.3326 4.7859 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> 15.8474 1.3981 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0<br /> 15.6394 0.4200 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> 16.0553 2.3762 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> 14.8692 1.6060 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> 14.2001 0.8629 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0<br /> 14.9432 0.1937 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> 13.4569 1.5320 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> 13.5309 0.1197 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> 12.5528 0.3276 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 11.8837 -0.4155 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 12.6268 -1.0846 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 11.1405 0.2536 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 11.2145 -1.1587 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0<br /> 10.2364 -0.9507 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 9.5673 -1.6939 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0<br /> 8.5891 -1.4860 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 7.9200 -2.2291 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 6.9418 -2.0212 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 6.2727 -2.7644 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0<br /> 5.2946 -2.5564 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 4.6254 -3.2996 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 3.6473 -3.0917 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0<br /> 11.5236 -2.1097 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> 9.9274 0.0003 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> 6.6328 -1.0702 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> 31 33 1 0 0 0 0<br /> 34 35 1 0 0 0 0<br /> 35 36 1 0 0 0 0<br /> 36 39 1 0 0 0 0<br /> 1 2 1 0 0 0 0<br /> 39 40 1 0 0 0 0<br /> 40 41 1 0 0 0 0<br /> 8 7 2 0 0 0 0<br /> 41 42 1 0 0 0 0<br /> 7 6 1 0 0 0 0<br /> 42 43 1 0 0 0 0<br /> 6 5 2 0 0 0 0<br /> 43 44 1 0 0 0 0<br /> 5 4 1 0 0 0 0<br /> 44 45 1 0 0 0 0<br /> 4 9 2 0 0 0 0<br /> 45 46 1 0 0 0 0<br /> 9 8 1 0 0 0 0<br /> 46 47 1 0 0 0 0<br /> 47 48 1 0 0 0 0<br /> 1 3 2 0 0 0 0<br /> 36 37 1 0 0 0 0<br /> 9 13 1 0 0 0 0<br /> 36 38 1 0 0 0 0<br /> 1 48 1 0 0 0 0<br /> 39 49 1 1 0 0 0<br /> 40 50 2 0 0 0 0<br /> 27 29 1 0 0 0 0<br /> 44 51 2 0 0 0 0<br /> 22 18 1 0 0 0 0<br /> 27 28 2 0 0 0 0<br /> 27 22 1 0 0 0 0<br /> 11 12 1 0 0 0 0<br /> 27 30 1 0 0 0 0<br /> 8 10 1 0 0 0 0<br /> 15 14 1 0 0 0 0<br /> 14 21 1 6 0 0 0<br /> 17 21 1 6 0 0 0<br /> 16 17 1 0 0 0 0<br /> 16 15 1 0 0 0 0<br /> 16 20 1 1 0 0 0<br /> 30 31 1 0 0 0 0<br /> 15 19 1 1 0 0 0<br /> 17 18 1 0 0 0 0<br /> 14 12 1 0 0 0 0<br /> 10 11 2 0 0 0 0<br /> 23 20 1 0 0 0 0<br /> 31 34 1 0 0 0 0<br /> 23 24 1 0 0 0 0<br /> 12 7 1 0 0 0 0<br /> 23 26 1 0 0 0 0<br /> 31 32 2 0 0 0 0<br /> 23 25 2 0 0 0 0<br /> S SKP 7<br /> ID BMFYS2ESa001<br /> NAME Acetyl-CoA<br /> FORMULA C23H38N7O17P3S<br /> EXACTMASS 809.1257<br /> AVERAGEMASS 809.572<br /> SMILES C(CNC(CCNC([C@H](O)C(C)(C)COP(OP(OC[C@@H](O1)[C@@H](OP(O)(O)=O)[C@@H](O)[C@@H]1n(c32)cnc2c(N)ncn3)(O)=O)(O)=O)=O)=O)SC(C)=O<br /> KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C00024<br /> M END<br /> &lt;/pre&gt;</div>

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