http://metabolomics.jp/mediawiki/index.php?action=history&feed=atom&title=Mol%3AFL5FEGNS0013 2026-09-03T23:17:25Z Revision history for this page on the wiki MediaWiki 1.19.1 http://metabolomics.jp/mediawiki/index.php?title=Mol:FL5FEGNS0013&diff=190755&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 /> 29 31 0 0 0 0 0 0 0 0999 V2000<br /> -1.4797 -1.8123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -1.9338 -1.3581 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -2.5543 -1.5244 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -2.7206 -2.1449 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -2.2664 -2.5990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -1.6459 -2.4328 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -3.3411 -2.3111 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -3.5073 -2.9316 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -3.0531 -3.3858 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -2.4326 -3.2195 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> -3.6952 -1.9569 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> -3.2193 -4.0060 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -3.8517 -4.1755 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -4.0211 -4.8078 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -3.5581 -5.2708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -2.9258 -5.1013 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -2.7563 -4.4690 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -3.0084 -1.0703 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> -4.2652 -5.9779 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> -1.2961 -1.0232 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> -2.1180 -1.0952 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -0.7895 -1.9972 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> 0.1765 -2.2560 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -4.4732 -3.1904 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> -5.4391 -3.4493 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -4.9870 -5.0666 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> -5.9529 -5.3254 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -2.7189 -5.7091 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> -2.3965 -6.6557 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 /> 3 18 1 0 0 0 0<br /> 15 19 1 0 0 0 0<br /> 2 20 1 0 0 0 0<br /> 20 21 1 0 0 0 0<br /> 1 22 1 0 0 0 0<br /> 22 23 1 0 0 0 0<br /> 8 24 1 0 0 0 0<br /> 24 25 1 0 0 0 0<br /> 14 26 1 0 0 0 0<br /> 26 27 1 0 0 0 0<br /> 16 28 1 0 0 0 0<br /> 28 29 1 0 0 0 0<br /> M STY 1 5 SUP<br /> M SLB 1 5 5<br /> M SAL 5 2 28 29<br /> M SBL 5 1 30<br /> M SMT 5 OCH3<br /> M SVB 5 30 1.5693 1.7424<br /> M STY 1 4 SUP<br /> M SLB 1 4 4<br /> M SAL 4 2 26 27<br /> M SBL 4 1 28<br /> M SMT 4 OCH3<br /> M SVB 4 28 2.0624 -0.022<br /> M STY 1 3 SUP<br /> M SLB 1 3 3<br /> M SAL 3 2 24 25<br /> M SBL 3 1 26<br /> M SMT 3 OCH3<br /> M SVB 3 26 0.3617 -0.9854<br /> M STY 1 2 SUP<br /> M SLB 1 2 2<br /> M SAL 2 2 22 23<br /> M SBL 2 1 24<br /> M SMT 2 OCH3<br /> M SVB 2 24 -2.4197 0.482<br /> M STY 1 1 SUP<br /> M SLB 1 1 1<br /> M SAL 1 2 20 21<br /> M SBL 1 1 22<br /> M SMT 1 OCH3<br /> M SVB 1 22 -2.7769 -0.6877<br /> S SKP 8<br /> ID FL5FEGNS0013<br /> KNApSAcK_ID C00004833<br /> NAME Murrayanol<br /> CAS_RN 76444-62-7<br /> FORMULA C20H20O9<br /> EXACTMASS 404.11073223799997<br /> AVERAGEMASS 404.3674<br /> SMILES c(c3OC)(OC)cc(O1)c(c3O)C(C(=C1c(c2)cc(OC)c(O)c2OC)OC)=O<br /> M END<br /> &lt;/pre&gt;</div>

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