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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 /> 29 31 0 0 0 0 0 0 0 0999 V2000<br /> -2.8930 -1.0645 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -2.2603 -0.9529 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -2.0406 -0.3493 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -2.4535 0.1428 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -3.0862 0.0312 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -3.3059 -0.5724 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -2.2338 0.7464 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -2.6467 1.2385 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -3.2794 1.1269 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -3.4991 0.5233 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> -1.7406 0.8333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> -3.6921 1.6188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -3.4682 2.2340 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -3.8890 2.7356 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -4.5337 2.6219 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -4.7577 2.0067 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -4.3368 1.5051 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -4.9545 3.1232 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> -1.4083 -0.2378 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> -4.8842 1.0459 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> -5.6503 0.4032 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -2.3518 -1.6674 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> -1.9394 -0.9528 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -2.3047 2.1781 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> -1.9626 3.1178 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -3.4402 -1.5237 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> -4.2063 -2.1665 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -3.9185 -0.3980 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> -4.8803 -0.1243 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 1 2 1 0 0 0 0<br /> 2 3 2 0 0 0 0<br /> 3 4 1 0 0 0 0<br /> 4 5 2 0 0 0 0<br /> 5 6 1 0 0 0 0<br /> 6 1 2 0 0 0 0<br /> 4 7 1 0 0 0 0<br /> 7 8 1 0 0 0 0<br /> 8 9 2 0 0 0 0<br /> 9 10 1 0 0 0 0<br /> 10 5 1 0 0 0 0<br /> 7 11 2 0 0 0 0<br /> 9 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 16 1 0 0 0 0<br /> 16 17 2 0 0 0 0<br /> 17 12 1 0 0 0 0<br /> 15 18 1 0 0 0 0<br /> 3 19 1 0 0 0 0<br /> 17 20 1 0 0 0 0<br /> 20 21 1 0 0 0 0<br /> 2 22 1 0 0 0 0<br /> 22 23 1 0 0 0 0<br /> 8 24 1 0 0 0 0<br /> 24 25 1 0 0 0 0<br /> 1 26 1 0 0 0 0<br /> 26 27 1 0 0 0 0<br /> 6 28 1 0 0 0 0<br /> 28 29 1 0 0 0 0<br /> M STY 1 5 SUP<br /> M SLB 1 5 5<br /> M SAL 5 2 28 29<br /> M SBL 5 1 30<br /> M SMT 5 OCH3<br /> M SVB 5 30 -1.0494 0.8998<br /> M STY 1 4 SUP<br /> M SLB 1 4 4<br /> M SAL 4 2 26 27<br /> M SBL 4 1 28<br /> M SMT 4 OCH3<br /> M SVB 4 28 -2.241 0.6243<br /> M STY 1 3 SUP<br /> M SLB 1 3 3<br /> M SAL 3 2 24 25<br /> M SBL 3 1 26<br /> M SMT 3 OCH3<br /> M SVB 3 26 0.5403 -0.843<br /> M STY 1 2 SUP<br /> M SLB 1 2 2<br /> M SAL 2 2 22 23<br /> M SBL 2 1 24<br /> M SMT 2 OCH3<br /> M SVB 2 24 -2.5983 -0.5453<br /> M STY 1 1 SUP<br /> M SLB 1 1 1<br /> M SAL 1 2 20 21<br /> M SBL 1 1 22<br /> M SMT 1 OCH3<br /> M SVB 1 22 0.5403 1.6001<br /> S SKP 8<br /> ID FL5FGLNS0002<br /> KNApSAcK_ID C00004782<br /> NAME 5,4'-Dihydroxy-3,6,7,8,2'-pentamethoxyflavone<br /> CAS_RN 70368-17-1<br /> FORMULA C20H20O9<br /> EXACTMASS 404.11073223799997<br /> AVERAGEMASS 404.3674<br /> SMILES c(c1)(O)ccc(C(O3)=C(C(c(c32)c(c(c(c(OC)2)OC)OC)O)=O)OC)c1OC<br /> M END<br /> &lt;/pre&gt;</div>

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