http://metabolomics.jp/mediawiki/index.php?action=history&feed=atom&title=Mol%3AFL5FDAGS0001 2026-09-03T19:51:58Z Revision history for this page on the wiki MediaWiki 1.19.1 http://metabolomics.jp/mediawiki/index.php?title=Mol:FL5FDAGS0001&diff=189987&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 /> 33 36 0 0 0 0 0 0 0 0999 V2000<br /> -0.3296 0.1320 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -0.3296 -0.5104 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 0.2267 -0.8316 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 0.7830 -0.5104 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 0.7830 0.1320 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 0.2267 0.4531 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 1.3393 -0.8316 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 1.8956 -0.5104 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 1.8956 0.1320 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 1.3393 0.4531 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> 1.3393 -1.8316 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> 2.4517 0.4530 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 3.0187 0.1257 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 3.5857 0.4530 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 3.5857 1.1077 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 3.0187 1.4351 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 2.4517 1.1077 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -0.8857 0.4530 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> 0.2267 -1.4737 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> 4.2196 1.4737 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> -3.5058 0.2351 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0<br /> -2.9902 -0.4455 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0<br /> -2.2477 -0.1568 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0<br /> -1.5312 -0.1491 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0<br /> -2.0519 0.3717 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> -2.7014 0.0288 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0<br /> -4.2196 -0.1770 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> -3.7940 -0.4847 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> -1.8222 -0.8710 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> 2.2941 -1.3422 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> 2.7262 -2.2440 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -2.8999 0.8994 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -3.8554 1.1944 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 /> 20 15 1 0 0 0 0<br /> 21 22 1 1 0 0 0<br /> 22 23 1 1 0 0 0<br /> 24 23 1 1 0 0 0<br /> 24 25 1 0 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 /> 22 28 1 0 0 0 0<br /> 23 29 1 0 0 0 0<br /> 24 18 1 0 0 0 0<br /> 8 30 1 0 0 0 0<br /> 30 31 1 0 0 0 0<br /> 26 32 1 0 0 0 0<br /> 32 33 1 0 0 0 0<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 CH2OH<br /> M SVB 2 35 -2.8999 0.8994<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 2.2941 -1.3422<br /> S SKP 8<br /> ID FL5FDAGS0001<br /> KNApSAcK_ID C00005264<br /> NAME Isokaempferide 7-glucoside<br /> CAS_RN 13454-27-8<br /> FORMULA C22H22O11<br /> EXACTMASS 462.116211546<br /> AVERAGEMASS 462.40348000000006<br /> SMILES c(c1)(O3)c(C(C(=C(c(c4)ccc(c4)O)3)OC)=O)c(O)cc1O[C@@H]([C@H]2O)OC(CO)[C@@H]([C@@H]2O)O<br /> M END<br /> &lt;/pre&gt;</div>

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