http://metabolomics.jp/mediawiki/index.php?action=history&feed=atom&title=Mol%3AFL4DACNN0002 2026-04-27T19:58:33Z Revision history for this page on the wiki MediaWiki 1.19.1 http://metabolomics.jp/mediawiki/index.php?title=Mol:FL4DACNN0002&diff=187329&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 /> 39 43 0 0 0 0 0 0 0 0999 V2000<br /> -3.3132 -0.2487 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -2.8138 0.0201 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -3.3132 -0.8157 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -2.8138 -1.1138 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -2.3143 -0.8450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -2.3143 -0.2781 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -1.8233 -1.1285 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -1.3323 -0.8450 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0<br /> -1.3323 -0.2781 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0<br /> -1.8233 0.0054 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> -1.3323 0.3960 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0<br /> -1.8233 -1.6716 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> -0.6938 0.7000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -0.1944 0.9688 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -0.6938 0.1331 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -0.1944 -0.1650 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 0.3051 0.1038 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 0.3051 0.6707 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -3.7995 0.0418 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> -2.8267 -1.6953 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> -0.6417 -1.0300 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> -1.1674 -1.4606 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0<br /> 0.8443 -0.0714 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0<br /> 1.1775 0.3872 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0<br /> 0.8443 0.8459 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> 1.8117 0.7534 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 2.3555 0.4394 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 2.8993 0.7534 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 2.8993 1.3813 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 2.3555 1.6953 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 1.8117 1.3813 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 3.4423 1.6948 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> 1.5844 -0.0197 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0<br /> 0.3847 -0.6192 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0<br /> -0.1815 1.5503 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> 0.8094 -0.4699 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 1.6063 -0.6834 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> 3.7653 0.2534 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> 4.6314 -0.2466 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 1 2 2 0 0 0 0<br /> 1 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 2 1 0 0 0 0<br /> 5 7 1 0 0 0 0<br /> 7 8 1 0 0 0 0<br /> 8 9 1 0 0 0 0<br /> 9 10 1 0 0 0 0<br /> 10 6 1 0 0 0 0<br /> 9 11 1 1 0 0 0<br /> 7 12 2 0 0 0 0<br /> 13 14 2 0 0 0 0<br /> 13 15 1 0 0 0 0<br /> 15 16 2 0 0 0 0<br /> 16 17 1 0 0 0 0<br /> 17 18 2 0 0 0 0<br /> 18 14 1 0 0 0 0<br /> 15 9 1 0 0 0 0<br /> 1 19 1 0 0 0 0<br /> 4 20 1 0 0 0 0<br /> 8 21 1 1 0 0 0<br /> 8 22 1 6 0 0 0<br /> 17 23 1 0 0 0 0<br /> 23 24 1 0 0 0 0<br /> 24 25 1 0 0 0 0<br /> 25 18 1 0 0 0 0<br /> 24 26 1 0 0 0 0<br /> 26 27 2 0 0 0 0<br /> 27 28 1 0 0 0 0<br /> 28 29 2 0 0 0 0<br /> 29 30 1 0 0 0 0<br /> 30 31 2 0 0 0 0<br /> 31 26 1 0 0 0 0<br /> 29 32 1 0 0 0 0<br /> 24 33 1 6 0 0 0<br /> 23 34 1 1 0 0 0<br /> 14 35 1 0 0 0 0<br /> 23 36 1 6 0 0 0<br /> 36 37 1 0 0 0 0<br /> 28 38 1 0 0 0 0<br /> 38 39 1 0 0 0 0<br /> M STY 1 2 SUP<br /> M SLB 1 2 2<br /> M SAL 2 2 36 37<br /> M SBL 2 1 40<br /> M SMT 2 CH2OH<br /> M SVB 2 40 0.8094 -0.4699<br /> M STY 1 1 SUP<br /> M SLB 1 1 1<br /> M SAL 1 2 38 39<br /> M SBL 1 1 42<br /> M SMT 1 OCH3<br /> M SVB 1 42 3.0851 0.5471<br /> S SKP 8<br /> ID FL4DACNN0002<br /> KNApSAcK_ID C00001004<br /> NAME Silychristin<br /> CAS_RN 33889-69-9<br /> FORMULA C25H22O10<br /> EXACTMASS 482.121296924<br /> AVERAGEMASS 482.43618000000004<br /> SMILES c(O4)(c3[C@@]([C@@](c(c5)cc(c(c5)O)OC)([H])4)([H])CO)c(cc(c3)[C@@](O1)([C@@]([H])(O)C(c(c(O)2)c1cc(O)c2)=O)[H])O<br /> M END<br /> &lt;/pre&gt;</div>

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