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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 /> 31 35 0 0 0 0 0 0 0 0999 V2000<br /> -1.9671 -0.1713 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -1.9671 -0.8137 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -1.4108 -1.1349 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -0.8545 -0.8137 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -0.8545 -0.1713 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -1.4108 0.1499 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -0.2982 -1.1349 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 0.2581 -0.8137 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 0.2581 -0.1713 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -0.2982 0.1499 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> -0.2982 -1.6357 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> 0.8142 0.1497 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 1.3812 -0.1776 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 1.9481 0.1497 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 1.9481 0.8044 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 1.3812 1.1318 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 0.8142 0.8044 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -2.5780 0.0272 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> -2.9556 -0.4925 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -2.5780 -1.0122 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> 2.5708 -0.0526 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> 2.9556 0.4771 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 2.5708 1.0067 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> -1.8472 -1.2954 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> -1.1328 -1.7079 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 1.1241 -1.3137 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> 1.9901 -1.8137 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -1.1328 0.7229 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> -0.6963 1.6226 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 1.1220 1.7192 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> 1.8972 2.0013 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 /> 1 18 1 0 0 0 0<br /> 18 19 1 0 0 0 0<br /> 19 20 1 0 0 0 0<br /> 20 2 1 0 0 0 0<br /> 14 21 1 0 0 0 0<br /> 21 22 1 0 0 0 0<br /> 22 23 1 0 0 0 0<br /> 23 15 1 0 0 0 0<br /> 3 24 1 0 0 0 0<br /> 24 25 1 0 0 0 0<br /> 8 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 /> 16 30 1 0 0 0 0<br /> 30 31 1 0 0 0 0<br /> M STY 1 4 SUP<br /> M SLB 1 4 4<br /> M SAL 4 2 30 31<br /> M SBL 4 1 34<br /> M SMT 4 OCH3<br /> M SVB 4 34 1.6646 1.7079<br /> M STY 1 3 SUP<br /> M SLB 1 3 3<br /> M SAL 3 2 28 29<br /> M SBL 3 1 32<br /> M SMT 3 OCH3<br /> M SVB 3 32 -1.1328 0.7229<br /> M STY 1 2 SUP<br /> M SLB 1 2 2<br /> M SAL 2 2 26 27<br /> M SBL 2 1 30<br /> M SMT 2 OCH3<br /> M SVB 2 30 0.4684 -0.9987<br /> M STY 1 1 SUP<br /> M SLB 1 1 1<br /> M SAL 1 2 24 25<br /> M SBL 1 1 28<br /> M SMT 1 OCH3<br /> M SVB 1 28 -1.8472 -1.2954<br /> S SKP 8<br /> ID FL5FGGNS0017<br /> KNApSAcK_ID C00005071<br /> NAME 3,5,8,3'-Tetramethoxy-6,7:4',5'-bis(methylenedioxy)flavone<br /> CAS_RN 82668-93-7<br /> FORMULA C21H18O10<br /> EXACTMASS 430.089996796<br /> AVERAGEMASS 430.36162<br /> SMILES COc(c21)cc(C(O3)=C(C(c(c(OC)4)c3c(OC)c(O5)c4OC5)=O)OC)cc(OCO2)1<br /> M END<br /> &lt;/pre&gt;</div>

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