http://metabolomics.jp/mediawiki/index.php?action=history&feed=atom&title=Mol%3AFL3FACCS0008 2026-05-17T04:31:53Z Revision history for this page on the wiki MediaWiki 1.19.1 http://metabolomics.jp/mediawiki/index.php?title=Mol:FL3FACCS0008&diff=185026&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 /> 35 38 0 0 0 0 0 0 0 0999 V2000<br /> -1.6839 -0.9567 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -1.6839 -1.5991 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -1.1276 -1.9203 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -0.5713 -1.5991 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -0.5713 -0.9567 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -1.1276 -0.6355 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -0.0150 -1.9203 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 0.5413 -1.5991 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 0.5413 -0.9567 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -0.0150 -0.6355 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> -0.0150 -2.4211 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> -2.2400 -0.6357 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> -0.8822 2.0489 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -1.4878 1.5901 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -1.2309 0.9295 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -1.2240 0.2920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -0.7607 0.7553 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> -1.0657 1.3332 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -1.1787 2.5624 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> -1.5226 2.3053 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> -1.8663 0.5510 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> -1.1276 -2.5624 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> 1.1592 -0.6150 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 1.7455 -0.9535 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 2.3317 -0.6150 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 2.3317 0.0619 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 1.7455 0.4003 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 1.1592 0.0619 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 2.9175 -0.9533 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> 2.9175 0.4001 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> -2.4724 0.9009 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -2.4724 1.4368 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -2.9175 0.6439 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> -0.6306 1.5845 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 0.0839 1.1720 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 /> 1 12 1 0 0 0 0<br /> 13 14 1 1 0 0 0<br /> 14 15 1 1 0 0 0<br /> 16 15 1 1 0 0 0<br /> 16 17 1 0 0 0 0<br /> 17 18 1 0 0 0 0<br /> 18 13 1 0 0 0 0<br /> 13 19 1 0 0 0 0<br /> 14 20 1 0 0 0 0<br /> 15 21 1 0 0 0 0<br /> 6 16 1 0 0 0 0<br /> 3 22 1 0 0 0 0<br /> 23 24 2 0 0 0 0<br /> 24 25 1 0 0 0 0<br /> 25 26 2 0 0 0 0<br /> 26 27 1 0 0 0 0<br /> 27 28 2 0 0 0 0<br /> 28 23 1 0 0 0 0<br /> 25 29 1 0 0 0 0<br /> 23 9 1 0 0 0 0<br /> 26 30 1 0 0 0 0<br /> 21 31 1 0 0 0 0<br /> 31 32 1 0 0 0 0<br /> 31 33 2 0 0 0 0<br /> 18 34 1 0 0 0 0<br /> 34 35 1 0 0 0 0<br /> M STY 1 1 SUP<br /> M SLB 1 1 1<br /> M SAL 1 2 34 35<br /> M SBL 1 1 37<br /> M SMT 1 CH2OH<br /> M SBV 1 37 -6.6484 5.6057<br /> S SKP 8<br /> ID FL3FACCS0008<br /> KNApSAcK_ID C00006140<br /> NAME Orientin 2''-acetate<br /> CAS_RN 71880-89-2<br /> FORMULA C23H22O12<br /> EXACTMASS 490.111126168<br /> AVERAGEMASS 490.41358<br /> SMILES Oc(c42)cc(O)c(c(OC(=CC(=O)4)c(c3)ccc(c3O)O)2)C(C(OC(C)=O)1)OC(C(C(O)1)O)CO<br /> M END<br /> &lt;/pre&gt;</div>

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