http://metabolomics.jp/mediawiki/index.php?action=history&feed=atom&title=Mol%3AFL1CDAGS0001 2026-05-16T23:33:30Z Revision history for this page on the wiki MediaWiki 1.19.1 http://metabolomics.jp/mediawiki/index.php?title=Mol:FL1CDAGS0001&diff=182042&oldid=prev 2009-03-14T00:00:00Z

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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 /> 33 35 0 0 0 0 0 0 0 0999 V2000<br /> -3.7155 0.3926 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -3.7155 -0.2471 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -3.1615 -0.5669 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -2.6075 -0.2471 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -2.6075 0.3926 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -3.1615 0.7125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -2.0538 -0.5668 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -1.5013 -0.2478 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -0.9500 -0.5661 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -0.3998 -0.2484 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 0.1386 -0.5593 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 0.6769 -0.2484 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 0.6769 0.3732 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 0.1386 0.6840 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -0.3998 0.3732 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -2.0538 -1.2048 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> 1.0711 0.6258 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> -3.1615 -1.2063 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> 2.1457 0.9590 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0<br /> 1.8449 0.4380 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0<br /> 2.4234 0.6033 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> 3.0053 0.4380 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0<br /> 3.3062 0.9590 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0<br /> 2.7277 0.7937 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0<br /> 1.5870 0.8093 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> 2.7692 1.2683 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> 3.8894 0.8028 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> -2.0538 0.7123 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> -1.3393 0.2998 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -4.0728 1.0114 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> -4.5728 1.8774 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 3.2049 0.1456 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 3.2049 -0.6794 0.0000 O 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 2 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 /> 17 13 1 0 0 0 0<br /> 3 18 1 0 0 0 0<br /> 19 20 1 0 0 0 0<br /> 20 21 1 1 0 0 0<br /> 21 22 1 1 0 0 0<br /> 23 22 1 1 0 0 0<br /> 23 24 1 0 0 0 0<br /> 24 19 1 0 0 0 0<br /> 19 25 1 0 0 0 0<br /> 24 26 1 0 0 0 0<br /> 23 27 1 0 0 0 0<br /> 17 20 1 0 0 0 0<br /> 5 28 1 0 0 0 0<br /> 28 29 1 0 0 0 0<br /> 1 30 1 0 0 0 0<br /> 30 31 1 0 0 0 0<br /> 22 32 1 0 0 0 0<br /> 32 33 1 0 0 0 0<br /> M STY 1 3 SUP<br /> M SLB 1 3 3<br /> M SAL 3 2 32 33<br /> M SBL 3 1 34<br /> M SMT 3 CH2OH<br /> M SVB 3 34 3.3583 0.4647<br /> M STY 1 2 SUP<br /> M SLB 1 2 2<br /> M SAL 2 2 30 31<br /> M SBL 2 1 32<br /> M SMT 2 OCH3<br /> M SVB 2 32 -4.0728 1.0114<br /> M STY 1 1 SUP<br /> M SLB 1 1 1<br /> M SAL 1 2 28 29<br /> M SBL 1 1 30<br /> M SMT 1 OCH3<br /> M SVB 1 30 -2.0538 0.7123<br /> S SKP 8<br /> ID FL1CDAGS0001<br /> KNApSAcK_ID C00007888<br /> NAME 4,2'-Dihydroxy-4',6'-dimethoxychalcone 4-glucoside<br /> CAS_RN 68984-71-4<br /> FORMULA C23H26O10<br /> EXACTMASS 462.152597052<br /> AVERAGEMASS 462.44654<br /> SMILES c(c3)(c(c(cc3OC)O)C(=O)C=Cc(c2)ccc(c2)O[C@@H](C(O)1)O[C@H](CO)[C@H](O)C1O)OC<br /> M END<br /> &lt;/pre&gt;</div>

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