http://metabolomics.jp/mediawiki/index.php?action=history&feed=atom&title=Mol%3AFL5FAAGI0001 2026-06-26T21:16:28Z Revision history for this page on the wiki MediaWiki 1.19.1 http://metabolomics.jp/mediawiki/index.php?title=Mol:FL5FAAGI0001&diff=187913&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 /> 38 41 0 0 0 0 0 0 0 0999 V2000<br /> -0.5618 0.6311 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -0.5618 -0.0113 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -0.0055 -0.3324 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 0.5508 -0.0113 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 0.5508 0.6311 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -0.0055 0.9523 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 1.1071 -0.3324 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 1.6634 -0.0113 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 1.6634 0.6311 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 1.1071 0.9523 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> 1.1071 -0.8333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> 2.2195 0.9522 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 2.7865 0.6248 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 3.3534 0.9522 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 3.3534 1.6069 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 2.7865 1.9342 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 2.2195 1.6069 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -1.1179 0.9522 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> -0.0055 -0.9746 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> 2.2195 -0.3323 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> 3.9376 1.9257 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> -3.4602 0.8045 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0<br /> -3.0333 0.2409 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0<br /> -2.4185 0.4800 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0<br /> -1.8253 0.4864 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0<br /> -2.2564 0.9176 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> -2.8844 0.6921 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0<br /> -4.0092 0.8526 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> -3.6988 0.2085 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> -2.0662 -0.1113 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> -1.1179 -0.3323 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -1.1179 -0.9731 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -1.6728 -1.2934 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -1.6728 -1.9342 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -2.2277 -0.9731 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -2.2265 -1.6131 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> -3.1196 1.4179 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -4.0976 1.6266 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 /> 2 31 1 0 0 0 0<br /> 31 32 1 0 0 0 0<br /> 32 33 1 0 0 0 0<br /> 33 34 1 0 0 0 0<br /> 33 35 1 0 0 0 0<br /> 33 36 1 0 0 0 0<br /> 27 37 1 0 0 0 0<br /> 37 38 1 0 0 0 0<br /> M STY 1 1 SUP<br /> M SLB 1 1 1<br /> M SAL 1 2 37 38<br /> M SBL 1 1 40<br /> M SMT 1 CH2OH<br /> M SVB 1 40 -3.1196 1.4179<br /> S SKP 8<br /> ID FL5FAAGI0001<br /> KNApSAcK_ID C00005804<br /> NAME Phellatin<br /> CAS_RN 32507-68-9<br /> FORMULA C26H30O12<br /> EXACTMASS 534.173726424<br /> AVERAGEMASS 534.5092<br /> SMILES OC(C(=O)1)=C(c(c4)ccc(O)c4)Oc(c2)c1c(c(c2O[C@@H]([C@H]3O)OC(CO)[C@H](O)[C@@H]3O)CCC(C)(C)O)O<br /> M END<br /> &lt;/pre&gt;</div>

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