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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 /> 36 39 0 0 0 0 0 0 0 0999 V2000<br /> -0.5308 -0.3231 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -0.5308 -0.9628 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 0.0232 -1.2827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 0.5772 -0.9628 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 0.5772 -0.3231 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 0.0232 -0.0033 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 1.1309 -1.2825 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 1.6834 -0.9635 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 2.2348 -1.2818 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 2.7849 -0.9642 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 3.3233 -1.2750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 3.8617 -0.9642 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 3.8617 -0.3425 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 3.3233 -0.0317 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 2.7849 -0.3425 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 1.1309 -1.9205 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> 0.0232 -1.9221 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> -1.0845 -0.0034 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> -1.0845 -1.2825 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -1.6382 -0.9628 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -1.6382 -0.3023 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -2.2102 0.0279 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -2.7822 -0.3023 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -2.7822 -0.9628 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -2.2102 -1.2931 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -2.2102 -1.9531 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> -2.2102 0.6879 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -2.7818 1.0179 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -2.7818 1.6414 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -3.3217 1.9531 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -3.8617 1.6414 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -3.8617 1.0179 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -3.3217 0.7062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -2.2424 1.9528 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> 1.1309 -0.0034 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> 1.8454 -0.4159 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 1 2 2 0 0 0 0<br /> 2 3 1 0 0 0 0<br /> 3 4 2 0 0 0 0<br /> 4 5 1 0 0 0 0<br /> 5 6 2 0 0 0 0<br /> 6 1 1 0 0 0 0<br /> 4 7 1 0 0 0 0<br /> 7 8 1 0 0 0 0<br /> 8 9 1 0 0 0 0<br /> 9 10 1 0 0 0 0<br /> 10 11 2 0 0 0 0<br /> 11 12 1 0 0 0 0<br /> 12 13 2 0 0 0 0<br /> 13 14 1 0 0 0 0<br /> 14 15 2 0 0 0 0<br /> 15 10 1 0 0 0 0<br /> 7 16 2 0 0 0 0<br /> 3 17 1 0 0 0 0<br /> 1 18 1 0 0 0 0<br /> 2 19 1 0 0 0 0<br /> 19 20 1 0 0 0 0<br /> 20 21 2 0 0 0 0<br /> 21 22 1 0 0 0 0<br /> 22 23 2 0 0 0 0<br /> 23 24 1 0 0 0 0<br /> 24 25 2 0 0 0 0<br /> 25 20 1 0 0 0 0<br /> 25 26 1 0 0 0 0<br /> 22 27 1 0 0 0 0<br /> 27 28 1 0 0 0 0<br /> 28 29 2 0 0 0 0<br /> 29 30 1 0 0 0 0<br /> 30 31 2 0 0 0 0<br /> 31 32 1 0 0 0 0<br /> 32 33 2 0 0 0 0<br /> 33 28 1 0 0 0 0<br /> 29 34 1 0 0 0 0<br /> 5 35 1 0 0 0 0<br /> 35 36 1 0 0 0 0<br /> M STY 1 1 SUP<br /> M SLB 1 1 1<br /> M SAL 1 2 35 36<br /> M SBL 1 1 38<br /> M SMT 1 OCH3<br /> M SBV 1 38 -4.2836 2.7809<br /> S SKP 8<br /> ID FL1DA9NC0005<br /> KNApSAcK_ID C00007964<br /> NAME Angoluvarin<br /> CAS_RN 110874-65-2<br /> FORMULA C30H28O6<br /> EXACTMASS 484.188588628<br /> AVERAGEMASS 484.53972000000005<br /> SMILES c(c4)(cccc4)CCC(=O)c(c(O)1)c(cc(O)c1Cc(c2O)cc(Cc(c3O)cccc3)cc2)OC<br /> M END<br /> &lt;/pre&gt;</div>

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