http://metabolomics.jp/mediawiki/index.php?action=history&feed=atom&title=Mol%3AFL5FFCGS0017 2026-05-17T03:56:32Z Revision history for this page on the wiki MediaWiki 1.19.1 http://metabolomics.jp/mediawiki/index.php?title=Mol:FL5FFCGS0017&diff=191101&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 /> 36 39 0 0 0 0 0 0 0 0999 V2000<br /> -0.5721 -0.1368 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -0.5721 -0.7791 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -0.0158 -1.1003 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 0.5405 -0.7791 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 0.5405 -0.1368 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -0.0158 0.1844 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 1.0968 -1.1003 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 1.6531 -0.7791 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 1.6531 -0.1368 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 1.0968 0.1844 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> 1.0968 -1.6012 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> 2.2092 0.1843 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 2.7761 -0.1431 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 3.3431 0.1843 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 3.3431 0.8390 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 2.7761 1.1663 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 2.2092 0.8390 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -1.1282 0.1843 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> -0.0158 -1.7424 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> 2.2092 -1.1002 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> 4.3431 0.8390 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> -3.4499 0.1603 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0<br /> -3.0230 -0.4032 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0<br /> -2.4082 -0.1641 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0<br /> -1.8150 -0.1577 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0<br /> -2.2460 0.2734 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> -2.8740 0.0479 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0<br /> -3.9271 0.4360 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> -3.6885 -0.4356 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> -2.0559 -0.7555 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> 3.0596 1.7424 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> 3.5011 2.6396 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 0.2622 0.7574 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> 0.6987 1.6571 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -3.1093 0.7738 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -2.4397 1.5165 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 /> 1 18 1 0 0 0 0<br /> 3 19 1 0 0 0 0<br /> 8 20 1 0 0 0 0<br /> 15 21 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 27 1 0 0 0 0<br /> 27 22 1 0 0 0 0<br /> 22 28 1 0 0 0 0<br /> 23 29 1 0 0 0 0<br /> 24 30 1 0 0 0 0<br /> 25 18 1 0 0 0 0<br /> 16 31 1 0 0 0 0<br /> 31 32 1 0 0 0 0<br /> 6 33 1 0 0 0 0<br /> 33 34 1 0 0 0 0<br /> 27 35 1 0 0 0 0<br /> 35 36 1 0 0 0 0<br /> M STY 1 3 SUP<br /> M SLB 1 3 3<br /> M SAL 3 2 35 36<br /> M SBL 3 1 38<br /> M SMT 3 CH2OH<br /> M SVB 3 38 -3.1093 0.7738<br /> M STY 1 2 SUP<br /> M SLB 1 2 2<br /> M SAL 2 2 33 34<br /> M SBL 2 1 36<br /> M SMT 2 OCH3<br /> M SVB 2 36 0.2622 0.7574<br /> M STY 1 1 SUP<br /> M SLB 1 1 1<br /> M SAL 1 2 31 32<br /> M SBL 1 1 34<br /> M SMT 1 OCH3<br /> M SVB 1 34 3.0596 1.7424<br /> S SKP 8<br /> ID FL5FFCGS0017<br /> KNApSAcK_ID C00005717<br /> NAME Limocitrin 7-glucoside<br /> CAS_RN 119628-58-9<br /> FORMULA C23H24O13<br /> EXACTMASS 508.121690854<br /> AVERAGEMASS 508.42886<br /> SMILES O(c(c1)c(O)ccc1C(=C4O)Oc(c(C4=O)3)c(OC)c(cc3O)O[C@@H]([C@@H](O)2)OC(CO)[C@@H]([C@@H]2O)O)C<br /> M END<br /> &lt;/pre&gt;</div>

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