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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 /> 60 64 0 0 0 0 0 0 0 0999 V2000<br /> 6.2529 -1.8123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 6.1578 -3.0208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 7.2778 -3.4848 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 8.0651 -2.5629 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 9.0459 -2.3678 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 9.8774 -1.8123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 11.0860 -1.9074 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 11.5499 -0.7873 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 10.6281 -0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 10.4330 0.9808 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 9.8774 1.8123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 9.9725 3.0208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 8.8525 3.4848 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 8.0651 2.5629 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 7.0844 2.3678 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 6.2529 1.8123 0.0000 C 0 0 0 0 0 0 0 0 0 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8.7035 -5.7135 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> 6.9348 4.0528 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> 7.4268 5.7135 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> 12.1179 1.1303 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> 13.7787 0.6384 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> 12.6535 -4.4653 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> 14.1303 -3.5603 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> 26 45 1 0 0 0 0<br /> 1 21 1 0 0 0 0<br /> 32 50 2 0 0 0 0<br /> 28 29 1 0 0 0 0<br /> 18 33 1 0 0 0 0<br /> 4 3 2 0 0 0 0<br /> 3 2 1 0 0 0 0<br /> 2 1 2 0 0 0 0<br /> 21 4 1 0 0 0 0<br /> 17 16 2 0 0 0 0<br /> 24 25 1 0 0 0 0<br /> 33 34 1 0 0 0 0<br /> 23 19 1 0 0 0 0<br /> 19 18 2 0 0 0 0<br /> 18 17 1 0 0 0 0<br /> 16 23 1 0 0 0 0<br /> 29 47 1 0 0 0 0<br /> 19 20 1 0 0 0 0<br /> 20 1 1 0 0 0 0<br /> 34 51 1 0 0 0 0<br /> 4 5 1 0 0 0 0<br /> 26 46 2 0 0 0 0<br /> 5 6 1 0 0 0 0<br /> 9 22 1 0 0 0 0<br /> 34 52 2 0 0 0 0<br /> 29 48 2 0 0 0 0<br /> 12 24 1 0 0 0 0<br /> 3 35 1 0 0 0 0<br /> 6 7 2 0 0 0 0<br /> 7 8 1 0 0 0 0<br /> 8 9 2 0 0 0 0<br /> 22 6 1 0 0 0 0<br /> 13 14 2 0 0 0 0<br /> 25 26 1 0 0 0 0<br /> 35 36 1 0 0 0 0<br /> 2 30 1 0 0 0 0<br /> 39 11 1 0 0 0 0<br /> 11 12 2 0 0 0 0<br /> 12 13 1 0 0 0 0<br /> 14 39 1 0 0 0 0<br /> 36 53 1 0 0 0 0<br /> 11 10 1 0 0 0 0<br /> 10 9 1 0 0 0 0<br /> 17 27 1 0 0 0 0<br /> 14 15 1 0 0 0 0<br /> 36 54 2 0 0 0 0<br /> 15 16 1 0 0 0 0<br /> 30 31 1 0 0 0 0<br /> 8 40 1 0 0 0 0<br /> 40 41 1 0 0 0 0<br /> 13 37 1 0 0 0 0<br /> 41 57 1 0 0 0 0<br /> 31 32 1 0 0 0 0<br /> 41 58 2 0 0 0 0<br /> 37 38 1 0 0 0 0<br /> 7 42 1 0 0 0 0<br /> 27 28 1 0 0 0 0<br /> 42 43 1 0 0 0 0<br /> 38 55 1 0 0 0 0<br /> 43 44 1 0 0 0 0<br /> 32 49 1 0 0 0 0<br /> 44 59 1 0 0 0 0<br /> 38 56 2 0 0 0 0<br /> 44 60 2 0 0 0 0<br /> S SKP 7<br /> ID BMCCPPPR0008<br /> NAME Uroporphyrinogen I<br /> FORMULA C40H44N4O16<br /> EXACTMASS 836.2752<br /> AVERAGEMASS 836.7947<br /> SMILES C(O)(=O)Cc(c21)c(c(Cc(c5CC(O)=O)nc(c5CCC(O)=O)Cc(c4CC(O)=O)nc(c4CCC(O)=O)Cc(c3CC(O)=O)nc(c3CCC(O)=O)C2)n1)CCC(O)=O<br /> KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C05766<br /> M END<br /> &lt;/pre&gt;</div>

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