http://metabolomics.jp/mediawiki/index.php?action=history&feed=atom&title=Mol%3AFL7AACGL0023 2026-05-16T11:03:51Z Revision history for this page on the wiki MediaWiki 1.19.1 http://metabolomics.jp/mediawiki/index.php?title=Mol:FL7AACGL0023&diff=192315&oldid=prev 2009-03-14T00:00:00Z

<p></p> <table class='diff diff-contentalign-left'> <col class='diff-marker' /> <col class='diff-content' /> <col class='diff-marker' /> <col class='diff-content' /> <tr valign='top'> <td colspan='2' style="background-color: white; color:black;">← Older revision</td> <td colspan='2' style="background-color: white; color:black;">Revision as of 00:00, 14 March 2009</td> </tr><tr><td colspan="2" class="diff-lineno">Line 1:</td> <td colspan="2" class="diff-lineno">Line 1:</td></tr> <tr><td class='diff-marker'>−</td><td style="background: #ffa; color:black; font-size: smaller;"><div><del class="diffchange diffchange-inline">&lt;pre&gt;</del></div></td><td class='diff-marker'>+</td><td style="background: #cfc; color:black; font-size: smaller;"><div><ins class="diffchange diffchange-inline"> </ins></div></td></tr> <tr><td class='diff-marker'>−</td><td style="background: #ffa; color:black; font-size: smaller;"><div>&#160;</div></td><td class='diff-marker'>+</td><td style="background: #cfc; color:black; 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color:black; font-size: smaller;"><div>&#160;&#160; &#160; 3.1513&#160; -2.0961&#160; &#160; 0.0000 C&#160; 0&#160; 0&#160; 0&#160; 0&#160; 0&#160; 0&#160; 0&#160; 0&#160; 0&#160; 0&#160; 0&#160; 0 &#160;</div></td></tr> <tr><td class='diff-marker'>−</td><td style="background: #ffa; color:black; font-size: smaller;"><div>&#160;&#160; &#160; 2.8555&#160; -2.6085&#160; &#160; 0.0000 O&#160; 0&#160; 0&#160; 0&#160; 0&#160; 0&#160; 0&#160; 0&#160; 0&#160; 0&#160; 0&#160; 0&#160; 0</div></td><td class='diff-marker'>+</td><td style="background: #cfc; color:black; font-size: smaller;"><div>&#160;&#160; &#160; 2.8555&#160; -2.6085&#160; &#160; 0.0000 O&#160; 0&#160; 0&#160; 0&#160; 0&#160; 0&#160; 0&#160; 0&#160; 0&#160; 0&#160; 0&#160; 0&#160; 0 &#160;</div></td></tr> <tr><td class='diff-marker'>−</td><td style="background: #ffa; color:black; font-size: smaller;"><div>&#160;&#160; &#160; 3.6383&#160; -2.0923&#160; &#160; 0.0000 C&#160; 0&#160; 0&#160; 0&#160; 0&#160; 0&#160; 0&#160; 0&#160; 0&#160; 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2&#160; 1&#160; 0&#160; 0&#160; 0&#160; 0</div></td><td class='diff-marker'>+</td><td style="background: #cfc; color:black; font-size: smaller;"><div>&#160;&#160; 1&#160; 2&#160; 1&#160; 0&#160; 0&#160; 0&#160; 0 &#160;</div></td></tr> <tr><td class='diff-marker'>−</td><td style="background: #ffa; color:black; font-size: smaller;"><div>&#160;&#160; 2&#160; 3&#160; 2&#160; 0&#160; 0&#160; 0&#160; 0</div></td><td class='diff-marker'>+</td><td style="background: #cfc; color:black; font-size: smaller;"><div>&#160;&#160; 2&#160; 3&#160; 2&#160; 0&#160; 0&#160; 0&#160; 0 &#160;</div></td></tr> <tr><td class='diff-marker'>−</td><td style="background: #ffa; color:black; font-size: smaller;"><div>&#160;&#160; 3&#160; 4&#160; 1&#160; 0&#160; 0&#160; 0&#160; 0</div></td><td class='diff-marker'>+</td><td style="background: #cfc; color:black; font-size: smaller;"><div>&#160;&#160; 3&#160; 4&#160; 1&#160; 0&#160; 0&#160; 0&#160; 0 &#160;</div></td></tr> <tr><td class='diff-marker'>−</td><td style="background: #ffa; color:black; font-size: smaller;"><div>&#160;&#160; 4&#160; 5&#160; 2&#160; 0&#160; 0&#160; 0&#160; 0</div></td><td class='diff-marker'>+</td><td style="background: #cfc; color:black; font-size: smaller;"><div>&#160;&#160; 4&#160; 5&#160; 2&#160; 0&#160; 0&#160; 0&#160; 0 &#160;</div></td></tr> <tr><td class='diff-marker'>−</td><td style="background: #ffa; color:black; font-size: smaller;"><div>&#160;&#160; 5&#160; 6&#160; 1&#160; 0&#160; 0&#160; 0&#160; 0</div></td><td class='diff-marker'>+</td><td style="background: #cfc; color:black; font-size: smaller;"><div>&#160;&#160; 5&#160; 6&#160; 1&#160; 0&#160; 0&#160; 0&#160; 0 &#160;</div></td></tr> <tr><td class='diff-marker'>−</td><td style="background: #ffa; color:black; font-size: smaller;"><div>&#160;&#160; 6&#160; 1&#160; 2&#160; 0&#160; 0&#160; 0&#160; 0</div></td><td class='diff-marker'>+</td><td style="background: #cfc; color:black; font-size: smaller;"><div>&#160;&#160; 6&#160; 1&#160; 2&#160; 0&#160; 0&#160; 0&#160; 0 &#160;</div></td></tr> <tr><td class='diff-marker'>−</td><td style="background: #ffa; color:black; font-size: smaller;"><div>&#160;&#160; 4&#160; 7&#160; 1&#160; 0&#160; 0&#160; 0&#160; 0</div></td><td class='diff-marker'>+</td><td style="background: #cfc; color:black; font-size: smaller;"><div>&#160;&#160; 4&#160; 7&#160; 1&#160; 0&#160; 0&#160; 0&#160; 0 &#160;</div></td></tr> <tr><td class='diff-marker'>−</td><td style="background: #ffa; color:black; font-size: smaller;"><div>&#160;&#160; 7&#160; 8&#160; 2&#160; 0&#160; 0&#160; 0&#160; 0</div></td><td class='diff-marker'>+</td><td style="background: #cfc; color:black; font-size: smaller;"><div>&#160;&#160; 7&#160; 8&#160; 2&#160; 0&#160; 0&#160; 0&#160; 0 &#160;</div></td></tr> <tr><td class='diff-marker'>−</td><td style="background: #ffa; color:black; font-size: smaller;"><div>&#160;&#160; 8&#160; 9&#160; 1&#160; 0&#160; 0&#160; 0&#160; 0</div></td><td class='diff-marker'>+</td><td style="background: #cfc; color:black; font-size: smaller;"><div>&#160;&#160; 8&#160; 9&#160; 1&#160; 0&#160; 0&#160; 0&#160; 0 &#160;</div></td></tr> <tr><td class='diff-marker'>−</td><td style="background: #ffa; color:black; font-size: smaller;"><div>&#160;&#160; 9 10&#160; 2&#160; 0&#160; 0&#160; 0&#160; 0</div></td><td class='diff-marker'>+</td><td style="background: #cfc; color:black; font-size: smaller;"><div>&#160;&#160; 9 10&#160; 2&#160; 0&#160; 0&#160; 0&#160; 0 &#160;</div></td></tr> <tr><td class='diff-marker'>−</td><td style="background: #ffa; color:black; font-size: smaller;"><div>&#160; 10&#160; 5&#160; 1&#160; 0&#160; 0&#160; 0&#160; 0</div></td><td class='diff-marker'>+</td><td style="background: #cfc; color:black; font-size: smaller;"><div>&#160; 10&#160; 5&#160; 1&#160; 0&#160; 0&#160; 0&#160; 0 &#160;</div></td></tr> <tr><td class='diff-marker'>−</td><td style="background: #ffa; color:black; font-size: smaller;"><div>&#160;&#160; 9 11&#160; 1&#160; 0&#160; 0&#160; 0&#160; 0</div></td><td class='diff-marker'>+</td><td style="background: #cfc; color:black; font-size: smaller;"><div>&#160;&#160; 9 11&#160; 1&#160; 0&#160; 0&#160; 0&#160; 0 &#160;</div></td></tr> <tr><td class='diff-marker'>−</td><td style="background: #ffa; color:black; font-size: smaller;"><div>&#160; 11 12&#160; 2&#160; 0&#160; 0&#160; 0&#160; 0</div></td><td class='diff-marker'>+</td><td style="background: #cfc; color:black; font-size: smaller;"><div>&#160; 11 12&#160; 2&#160; 0&#160; 0&#160; 0&#160; 0 &#160;</div></td></tr> <tr><td class='diff-marker'>−</td><td style="background: #ffa; color:black; font-size: smaller;"><div>&#160; 12 13&#160; 1&#160; 0&#160; 0&#160; 0&#160; 0</div></td><td class='diff-marker'>+</td><td style="background: #cfc; color:black; font-size: smaller;"><div>&#160; 12 13&#160; 1&#160; 0&#160; 0&#160; 0&#160; 0 &#160;</div></td></tr> <tr><td class='diff-marker'>−</td><td style="background: #ffa; color:black; font-size: smaller;"><div>&#160; 13 14&#160; 2&#160; 0&#160; 0&#160; 0&#160; 0</div></td><td class='diff-marker'>+</td><td style="background: #cfc; color:black; font-size: smaller;"><div>&#160; 13 14&#160; 2&#160; 0&#160; 0&#160; 0&#160; 0 &#160;</div></td></tr> <tr><td class='diff-marker'>−</td><td style="background: #ffa; color:black; font-size: smaller;"><div>&#160; 14 15&#160; 1&#160; 0&#160; 0&#160; 0&#160; 0</div></td><td class='diff-marker'>+</td><td style="background: #cfc; color:black; font-size: smaller;"><div>&#160; 14 15&#160; 1&#160; 0&#160; 0&#160; 0&#160; 0 &#160;</div></td></tr> <tr><td class='diff-marker'>−</td><td style="background: #ffa; color:black; font-size: smaller;"><div>&#160; 15 16&#160; 2&#160; 0&#160; 0&#160; 0&#160; 0</div></td><td class='diff-marker'>+</td><td style="background: #cfc; color:black; font-size: smaller;"><div>&#160; 15 16&#160; 2&#160; 0&#160; 0&#160; 0&#160; 0 &#160;</div></td></tr> <tr><td class='diff-marker'>−</td><td style="background: #ffa; color:black; font-size: smaller;"><div>&#160; 16 11&#160; 1&#160; 0&#160; 0&#160; 0&#160; 0</div></td><td class='diff-marker'>+</td><td style="background: #cfc; color:black; font-size: smaller;"><div>&#160; 16 11&#160; 1&#160; 0&#160; 0&#160; 0&#160; 0 &#160;</div></td></tr> <tr><td class='diff-marker'>−</td><td style="background: #ffa; color:black; font-size: smaller;"><div>&#160;&#160; 1 17&#160; 1&#160; 0&#160; 0&#160; 0&#160; 0</div></td><td class='diff-marker'>+</td><td style="background: #cfc; color:black; font-size: smaller;"><div>&#160;&#160; 1 17&#160; 1&#160; 0&#160; 0&#160; 0&#160; 0 &#160;</div></td></tr> <tr><td class='diff-marker'>−</td><td style="background: #ffa; color:black; font-size: smaller;"><div>&#160; 14 18&#160; 1&#160; 0&#160; 0&#160; 0&#160; 0</div></td><td class='diff-marker'>+</td><td style="background: #cfc; color:black; font-size: smaller;"><div>&#160; 14 18&#160; 1&#160; 0&#160; 0&#160; 0&#160; 0 &#160;</div></td></tr> <tr><td class='diff-marker'>−</td><td style="background: #ffa; color:black; font-size: smaller;"><div>&#160;&#160; 3 19&#160; 1&#160; 0&#160; 0&#160; 0&#160; 0</div></td><td class='diff-marker'>+</td><td style="background: #cfc; color:black; font-size: smaller;"><div>&#160;&#160; 3 19&#160; 1&#160; 0&#160; 0&#160; 0&#160; 0 &#160;</div></td></tr> <tr><td class='diff-marker'>−</td><td style="background: #ffa; color:black; font-size: smaller;"><div>&#160; 20&#160; 8&#160; 1&#160; 0&#160; 0&#160; 0&#160; 0</div></td><td class='diff-marker'>+</td><td style="background: #cfc; color:black; font-size: smaller;"><div>&#160; 20&#160; 8&#160; 1&#160; 0&#160; 0&#160; 0&#160; 0 &#160;</div></td></tr> <tr><td class='diff-marker'>−</td><td style="background: #ffa; color:black; font-size: smaller;"><div>&#160; 21 22&#160; 1&#160; 0&#160; 0&#160; 0&#160; 0</div></td><td class='diff-marker'>+</td><td style="background: #cfc; color:black; font-size: smaller;"><div>&#160; 21 22&#160; 1&#160; 0&#160; 0&#160; 0&#160; 0 &#160;</div></td></tr> <tr><td class='diff-marker'>−</td><td style="background: #ffa; color:black; font-size: smaller;"><div>&#160; 22 23&#160; 1&#160; 1&#160; 0&#160; 0&#160; 0</div></td><td class='diff-marker'>+</td><td style="background: #cfc; color:black; font-size: smaller;"><div>&#160; 22 23&#160; 1&#160; 1&#160; 0&#160; 0&#160; 0 &#160;</div></td></tr> <tr><td class='diff-marker'>−</td><td style="background: #ffa; color:black; font-size: smaller;"><div>&#160; 23 24&#160; 1&#160; 1&#160; 0&#160; 0&#160; 0</div></td><td class='diff-marker'>+</td><td style="background: #cfc; color:black; font-size: smaller;"><div>&#160; 23 24&#160; 1&#160; 1&#160; 0&#160; 0&#160; 0 &#160;</div></td></tr> <tr><td class='diff-marker'>−</td><td style="background: #ffa; color:black; font-size: smaller;"><div>&#160; 25 24&#160; 1&#160; 1&#160; 0&#160; 0&#160; 0</div></td><td class='diff-marker'>+</td><td style="background: #cfc; color:black; font-size: smaller;"><div>&#160; 25 24&#160; 1&#160; 1&#160; 0&#160; 0&#160; 0 &#160;</div></td></tr> <tr><td class='diff-marker'>−</td><td style="background: #ffa; color:black; font-size: smaller;"><div>&#160; 25 26&#160; 1&#160; 0&#160; 0&#160; 0&#160; 0</div></td><td class='diff-marker'>+</td><td style="background: #cfc; color:black; font-size: smaller;"><div>&#160; 25 26&#160; 1&#160; 0&#160; 0&#160; 0&#160; 0 &#160;</div></td></tr> <tr><td class='diff-marker'>−</td><td style="background: #ffa; color:black; font-size: smaller;"><div>&#160; 26 21&#160; 1&#160; 0&#160; 0&#160; 0&#160; 0</div></td><td class='diff-marker'>+</td><td style="background: #cfc; color:black; font-size: smaller;"><div>&#160; 26 21&#160; 1&#160; 0&#160; 0&#160; 0&#160; 0 &#160;</div></td></tr> <tr><td class='diff-marker'>−</td><td style="background: #ffa; color:black; font-size: smaller;"><div>&#160; 21 27&#160; 1&#160; 0&#160; 0&#160; 0&#160; 0</div></td><td class='diff-marker'>+</td><td style="background: #cfc; color:black; font-size: smaller;"><div>&#160; 21 27&#160; 1&#160; 0&#160; 0&#160; 0&#160; 0 &#160;</div></td></tr> <tr><td class='diff-marker'>−</td><td style="background: #ffa; color:black; font-size: smaller;"><div>&#160; 26 28&#160; 1&#160; 0&#160; 0&#160; 0&#160; 0</div></td><td class='diff-marker'>+</td><td style="background: #cfc; color:black; font-size: smaller;"><div>&#160; 26 28&#160; 1&#160; 0&#160; 0&#160; 0&#160; 0 &#160;</div></td></tr> <tr><td class='diff-marker'>−</td><td style="background: #ffa; color:black; font-size: smaller;"><div>&#160; 25 29&#160; 1&#160; 0&#160; 0&#160; 0&#160; 0</div></td><td class='diff-marker'>+</td><td style="background: #cfc; color:black; font-size: smaller;"><div>&#160; 25 29&#160; 1&#160; 0&#160; 0&#160; 0&#160; 0 &#160;</div></td></tr> <tr><td class='diff-marker'>−</td><td style="background: #ffa; color:black; font-size: smaller;"><div>&#160; 22 20&#160; 1&#160; 0&#160; 0&#160; 0&#160; 0</div></td><td class='diff-marker'>+</td><td style="background: #cfc; color:black; font-size: smaller;"><div>&#160; 22 20&#160; 1&#160; 0&#160; 0&#160; 0&#160; 0 &#160;</div></td></tr> <tr><td class='diff-marker'>−</td><td style="background: #ffa; color:black; font-size: smaller;"><div>&#160; 24 30&#160; 1&#160; 0&#160; 0&#160; 0&#160; 0</div></td><td class='diff-marker'>+</td><td style="background: #cfc; color:black; font-size: smaller;"><div>&#160; 24 30&#160; 1&#160; 0&#160; 0&#160; 0&#160; 0 &#160;</div></td></tr> <tr><td class='diff-marker'>−</td><td style="background: #ffa; color:black; font-size: smaller;"><div>&#160; 30 31&#160; 1&#160; 0&#160; 0&#160; 0&#160; 0</div></td><td class='diff-marker'>+</td><td style="background: #cfc; color:black; font-size: smaller;"><div>&#160; 30 31&#160; 1&#160; 0&#160; 0&#160; 0&#160; 0 &#160;</div></td></tr> <tr><td class='diff-marker'>−</td><td style="background: #ffa; color:black; font-size: smaller;"><div>&#160; 31 32&#160; 1&#160; 0&#160; 0&#160; 0&#160; 0</div></td><td class='diff-marker'>+</td><td style="background: #cfc; color:black; font-size: smaller;"><div>&#160; 31 32&#160; 1&#160; 0&#160; 0&#160; 0&#160; 0 &#160;</div></td></tr> <tr><td class='diff-marker'>−</td><td style="background: #ffa; color:black; font-size: smaller;"><div>&#160; 32 33&#160; 2&#160; 0&#160; 0&#160; 0&#160; 0</div></td><td class='diff-marker'>+</td><td style="background: #cfc; color:black; font-size: smaller;"><div>&#160; 32 33&#160; 2&#160; 0&#160; 0&#160; 0&#160; 0 &#160;</div></td></tr> <tr><td class='diff-marker'>−</td><td style="background: #ffa; color:black; font-size: smaller;"><div>&#160; 32 34&#160; 1&#160; 0&#160; 0&#160; 0&#160; 0</div></td><td class='diff-marker'>+</td><td style="background: #cfc; color:black; font-size: smaller;"><div>&#160; 32 34&#160; 1&#160; 0&#160; 0&#160; 0&#160; 0 &#160;</div></td></tr> <tr><td class='diff-marker'>−</td><td style="background: #ffa; color:black; font-size: smaller;"><div>&#160; 15 35&#160; 1&#160; 0&#160; 0&#160; 0&#160; 0</div></td><td class='diff-marker'>+</td><td style="background: #cfc; color:black; font-size: smaller;"><div>&#160; 15 35&#160; 1&#160; 0&#160; 0&#160; 0&#160; 0 &#160;</div></td></tr> <tr><td class='diff-marker'>−</td><td style="background: #ffa; color:black; font-size: smaller;"><div>S&#160; SKP&#160; 8</div></td><td class='diff-marker'>+</td><td style="background: #cfc; color:black; font-size: smaller;"><div>S&#160; SKP&#160; 8 &#160;</div></td></tr> <tr><td class='diff-marker'>−</td><td style="background: #ffa; color:black; font-size: smaller;"><div>ID FL7AACGL0023</div></td><td class='diff-marker'>+</td><td style="background: #cfc; color:black; font-size: smaller;"><div>ID FL7AACGL0023 &#160;</div></td></tr> <tr><td class='diff-marker'>−</td><td style="background: #ffa; color:black; font-size: smaller;"><div>KNApSAcK_ID C00006793</div></td><td class='diff-marker'>+</td><td style="background: #cfc; color:black; font-size: smaller;"><div>KNApSAcK_ID C00006793 &#160;</div></td></tr> <tr><td class='diff-marker'>−</td><td style="background: #ffa; color:black; font-size: smaller;"><div>NAME Cyanidin 3-(6''-acetylglucoside)</div></td><td class='diff-marker'>+</td><td style="background: #cfc; color:black; font-size: smaller;"><div>NAME Cyanidin 3-(6''-acetylglucoside) &#160;</div></td></tr> <tr><td class='diff-marker'>−</td><td style="background: #ffa; color:black; font-size: smaller;"><div>CAS_RN 133080-31-6</div></td><td class='diff-marker'>+</td><td style="background: #cfc; color:black; font-size: smaller;"><div>CAS_RN 133080-31-6 &#160;</div></td></tr> <tr><td class='diff-marker'>−</td><td style="background: #ffa; color:black; font-size: smaller;"><div>FORMULA C23H23O12</div></td><td class='diff-marker'>+</td><td style="background: #cfc; color:black; font-size: smaller;"><div>FORMULA C23H23O12 &#160;</div></td></tr> <tr><td class='diff-marker'>−</td><td style="background: #ffa; color:black; font-size: smaller;"><div>EXACTMASS 491.1189512</div></td><td class='diff-marker'>+</td><td style="background: #cfc; color:black; font-size: smaller;"><div>EXACTMASS 491.1189512 &#160;</div></td></tr> <tr><td class='diff-marker'>−</td><td style="background: #ffa; color:black; font-size: smaller;"><div>AVERAGEMASS 491.42152</div></td><td class='diff-marker'>+</td><td style="background: #cfc; color:black; font-size: smaller;"><div>AVERAGEMASS 491.42152 &#160;</div></td></tr> <tr><td class='diff-marker'>−</td><td style="background: #ffa; color:black; font-size: smaller;"><div>SMILES C(C(O1)C(C(C(O)C1Oc(c3c(c4)ccc(c4O)O)cc(c(O)2)c([o+1]3)cc(O)c2)O)O)OC(C)=O</div></td><td class='diff-marker'>+</td><td style="background: #cfc; color:black; font-size: smaller;"><div>SMILES C(C(O1)C(C(C(O)C1Oc(c3c(c4)ccc(c4O)O)cc(c(O)2)c([o+1]3)cc(O)c2)O)O)OC(C)=O &#160;</div></td></tr> <tr><td class='diff-marker'>&#160;</td><td style="background: #eee; color:black; font-size: smaller;"><div>M&#160; END</div></td><td class='diff-marker'>&#160;</td><td style="background: #eee; color:black; font-size: smaller;"><div>M&#160; END</div></td></tr> <tr><td class='diff-marker'>−</td><td style="background: #ffa; color:black; font-size: smaller;"><div><del style="color: red; font-weight: bold; text-decoration: none;">&lt;/pre&gt;</del></div></td><td colspan="2">&#160;</td></tr> </table>

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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 /> -3.0822 0.6509 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -3.0822 0.0085 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -2.5259 -0.3127 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -1.9696 0.0085 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -1.9696 0.6509 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -2.5259 0.9721 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -1.4133 -0.3127 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -0.8570 0.0085 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -0.8570 0.6509 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -1.4133 0.9721 0.0000 O 0 3 0 0 0 0 0 0 0 0 0 0<br /> -0.3009 0.9719 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 0.2661 0.6446 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 0.8331 0.9719 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 0.8331 1.6266 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 0.2661 1.9540 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -0.3009 1.6266 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -3.6383 0.9719 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> 1.3999 1.9539 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> -2.5259 -0.9548 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> -0.4409 -0.7122 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> 1.0620 -0.7360 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 0.7938 -1.2005 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 1.3096 -1.0531 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> 1.8285 -1.2005 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 2.0968 -0.7360 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 1.5809 -0.8833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 0.5638 -0.8694 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> 1.7226 -0.3546 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> 2.5039 -0.7360 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> 2.3781 -1.0533 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 2.5763 -1.7641 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> 3.1513 -2.0961 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 2.8555 -2.6085 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> 3.6383 -2.0923 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 0.2661 2.6085 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 2 0 0 0 0<br /> 8 9 1 0 0 0 0<br /> 9 10 2 0 0 0 0<br /> 10 5 1 0 0 0 0<br /> 9 11 1 0 0 0 0<br /> 11 12 2 0 0 0 0<br /> 12 13 1 0 0 0 0<br /> 13 14 2 0 0 0 0<br /> 14 15 1 0 0 0 0<br /> 15 16 2 0 0 0 0<br /> 16 11 1 0 0 0 0<br /> 1 17 1 0 0 0 0<br /> 14 18 1 0 0 0 0<br /> 3 19 1 0 0 0 0<br /> 20 8 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 20 1 0 0 0 0<br /> 24 30 1 0 0 0 0<br /> 30 31 1 0 0 0 0<br /> 31 32 1 0 0 0 0<br /> 32 33 2 0 0 0 0<br /> 32 34 1 0 0 0 0<br /> 15 35 1 0 0 0 0<br /> S SKP 8<br /> ID FL7AACGL0023<br /> KNApSAcK_ID C00006793<br /> NAME Cyanidin 3-(6''-acetylglucoside)<br /> CAS_RN 133080-31-6<br /> FORMULA C23H23O12<br /> EXACTMASS 491.1189512<br /> AVERAGEMASS 491.42152<br /> SMILES C(C(O1)C(C(C(O)C1Oc(c3c(c4)ccc(c4O)O)cc(c(O)2)c([o+1]3)cc(O)c2)O)O)OC(C)=O<br /> M END<br /> &lt;/pre&gt;</div>

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