http://metabolomics.jp/mediawiki/index.php?action=history&feed=atom&title=Mol%3AFL3FAIGS0007 2026-08-14T02:06:59Z Revision history for this page on the wiki MediaWiki 1.19.1 http://metabolomics.jp/mediawiki/index.php?title=Mol:FL3FAIGS0007&diff=185659&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 /> 35 38 0 0 0 0 0 0 0 0999 V2000<br /> -3.4961 -0.2976 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -3.4961 -0.8597 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -3.0451 -1.1202 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -2.5940 -0.8597 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -2.5940 -0.3389 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -3.0451 -0.0785 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -2.1429 -1.1202 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -1.6919 -0.8597 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -1.6919 -0.3389 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -2.1429 -0.0785 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> -1.9713 -1.4880 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> -1.2410 -0.0786 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -0.7813 -0.3440 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -0.3215 -0.0786 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -0.3215 0.4523 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -0.7813 0.7177 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -1.2410 0.4523 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -3.0451 -1.6399 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> 0.6785 0.4523 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> -4.0400 -0.1519 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> 1.7056 1.3212 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0<br /> 1.3179 0.6498 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0<br /> 2.0634 0.8629 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> 2.8133 0.6498 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0<br /> 3.2011 1.3212 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0<br /> 2.4556 1.1083 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0<br /> 0.9856 1.1283 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> 2.7625 1.6399 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> 3.7604 0.9983 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> 0.5445 -0.5786 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> 1.4105 -1.0786 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -0.5514 1.2629 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> -0.1629 2.1843 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 3.3255 0.6765 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 4.0400 0.2640 0.0000 O 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 /> 3 18 1 0 0 0 0<br /> 15 19 1 0 0 0 0<br /> 20 1 1 0 0 0 0<br /> 21 22 1 0 0 0 0<br /> 22 23 1 1 0 0 0<br /> 23 24 1 1 0 0 0<br /> 25 24 1 1 0 0 0<br /> 25 26 1 0 0 0 0<br /> 26 21 1 0 0 0 0<br /> 21 27 1 0 0 0 0<br /> 26 28 1 0 0 0 0<br /> 25 29 1 0 0 0 0<br /> 22 19 1 0 0 0 0<br /> 14 30 1 0 0 0 0<br /> 30 31 1 0 0 0 0<br /> 16 32 1 0 0 0 0<br /> 32 33 1 0 0 0 0<br /> 24 34 1 0 0 0 0<br /> 34 35 1 0 0 0 0<br /> M STY 1 3 SUP<br /> M SLB 1 3 3<br /> M SAL 3 2 34 35<br /> M SBL 3 1 37<br /> M SMT 3 CH2OH<br /> M SVB 3 37 3.3255 0.6765<br /> M STY 1 2 SUP<br /> M SLB 1 2 2<br /> M SAL 2 2 32 33<br /> M SBL 2 1 35<br /> M SMT 2 OCH3<br /> M SVB 2 35 -0.5514 1.2629<br /> M STY 1 1 SUP<br /> M SLB 1 1 1<br /> M SAL 1 2 30 31<br /> M SBL 1 1 33<br /> M SMT 1 OCH3<br /> M SVB 1 33 -0.2191 -0.2848<br /> S SKP 8<br /> ID FL3FAIGS0007<br /> KNApSAcK_ID C00004465<br /> NAME Tricin 4'-glucoside<br /> CAS_RN 71855-50-0<br /> FORMULA C23H24O12<br /> EXACTMASS 492.126776232<br /> AVERAGEMASS 492.42946<br /> SMILES [C@H](O4)(C(O)C([C@H]([C@@H](CO)4)O)O)Oc(c(OC)3)c(OC)cc(c3)C(O2)=CC(c(c21)c(O)cc(O)c1)=O<br /> M END<br /> &lt;/pre&gt;</div>

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