http://metabolomics.jp/mediawiki/index.php?action=history&feed=atom&title=Mol%3AFL4DAAGP0001 2026-05-24T16:34:32Z Revision history for this page on the wiki MediaWiki 1.19.1 http://metabolomics.jp/mediawiki/index.php?title=Mol:FL4DAAGP0001&diff=187161&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 /> 37 41 0 0 0 0 0 0 0 0999 V2000<br /> -2.4447 -0.3135 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -1.9238 -0.6143 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -1.4029 -0.3135 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -1.4029 0.2879 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -1.9238 0.5887 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -2.4447 0.2879 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -0.8820 -0.6143 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -0.3611 -0.3135 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0<br /> -0.3611 0.2879 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0<br /> -0.8820 0.5887 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> -0.8820 -1.1382 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> 0.2186 0.5874 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 0.7473 0.2821 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 1.2760 0.5874 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 1.2760 1.1979 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 0.7473 1.5032 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 0.2186 1.1979 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -2.8953 0.5752 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> 0.1071 -0.8902 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> 1.8047 1.5031 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> -1.9238 -1.2151 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> 1.4983 -0.6262 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0<br /> 1.1056 -1.3063 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0<br /> 1.8607 -1.0905 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> 2.6204 -1.3063 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0<br /> 3.0131 -0.6262 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0<br /> 2.2580 -0.8419 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0<br /> 0.7690 -0.8216 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> 2.5689 -0.3034 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> 3.3932 -0.4878 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> -1.9238 1.1320 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -2.3943 1.4036 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -2.9041 1.1723 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -3.1717 1.6357 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -3.4461 1.0271 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 3.4461 -1.6357 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 3.5896 -2.6253 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> 1 2 2 0 0 0 0<br /> 2 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 1 1 0 0 0 0<br /> 3 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 4 1 0 0 0 0<br /> 7 11 2 0 0 0 0<br /> 9 12 1 6 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 /> 6 18 1 0 0 0 0<br /> 8 19 1 1 0 0 0<br /> 15 20 1 0 0 0 0<br /> 2 21 1 0 0 0 0<br /> 22 23 1 0 0 0 0<br /> 23 24 1 1 0 0 0<br /> 24 25 1 1 0 0 0<br /> 26 25 1 1 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 /> 27 29 1 0 0 0 0<br /> 26 30 1 0 0 0 0<br /> 23 19 1 0 0 0 0<br /> 5 31 1 0 0 0 0<br /> 31 32 1 0 0 0 0<br /> 32 33 1 0 0 0 0<br /> 33 18 1 0 0 0 0<br /> 33 34 1 0 0 0 0<br /> 33 35 1 0 0 0 0<br /> 25 36 1 0 0 0 0<br /> 36 37 1 0 0 0 0<br /> M STY 1 1 SUP<br /> M SLB 1 1 1<br /> M SAL 1 2 36 37<br /> M SBL 1 1 40<br /> M SMT 1 CH2OH<br /> M SVB 1 40 3.4461 -1.6357<br /> S SKP 8<br /> ID FL4DAAGP0001<br /> KNApSAcK_ID C00008730<br /> NAME Phellodendroside<br /> CAS_RN 40451-69-2<br /> FORMULA C26H30O11<br /> EXACTMASS 518.1788118019999<br /> AVERAGEMASS 518.5098<br /> SMILES c(O)(c5)ccc(c5)[C@@H](O1)[C@@H](O[C@@H](C(O)4)O[C@@H]([C@@H](C(O)4)O)CO)C(c(c2O)c1c(C3)c(OC(C3)(C)C)c2)=O<br /> M END<br /> &lt;/pre&gt;</div>

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