http://metabolomics.jp/mediawiki/index.php?action=history&feed=atom&title=Mol%3AFL5FFCNSS002 2026-10-11T09:59:26Z Revision history for this page on the wiki MediaWiki 1.19.1 http://metabolomics.jp/mediawiki/index.php?title=Mol:FL5FFCNSS002&diff=191217&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 35 0 0 0 0 0 0 0 0999 V2000<br /> -2.1546 -0.6618 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -2.1546 -1.3041 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -1.5983 -1.6253 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -1.0420 -1.3041 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -1.0420 -0.6618 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -1.5983 -0.3406 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -0.4857 -1.6253 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 0.0706 -1.3041 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 0.0706 -0.6618 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -0.4857 -0.3406 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> -0.4857 -2.1262 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> 0.7711 -0.2170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 1.3380 -0.5443 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 1.9050 -0.2170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 1.9050 0.4377 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 1.3380 0.7651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 0.7711 0.4377 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -1.5983 -2.2675 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> 2.5118 0.7881 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> 1.8873 -1.8858 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> 1.2658 -1.8858 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0<br /> 1.2658 -1.4038 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> 0.7502 -1.8858 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> 1.2658 -2.4359 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> 1.3162 1.5148 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> 1.3162 2.0025 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0<br /> 1.6984 2.0025 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> 1.3162 2.4359 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> 0.8112 2.0025 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> -2.5118 -0.0430 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> -3.0117 0.8231 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -1.3433 0.2191 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> -0.9287 1.1291 0.0000 C 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 /> 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 /> 3 18 1 0 0 0 0<br /> 19 15 1 0 0 0 0<br /> 4 3 1 0 0 0 0<br /> 20 21 1 0 0 0 0<br /> 21 22 2 0 0 0 0<br /> 21 23 1 0 0 0 0<br /> 21 24 2 0 0 0 0<br /> 23 8 1 0 0 0 0<br /> 25 26 1 0 0 0 0<br /> 26 27 2 0 0 0 0<br /> 26 28 1 0 0 0 0<br /> 26 29 2 0 0 0 0<br /> 16 25 1 0 0 0 0<br /> 1 30 1 0 0 0 0<br /> 30 31 1 0 0 0 0<br /> 6 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 34<br /> M SMT 2 OCH3<br /> M SVB 2 34 -1.3433 0.2191<br /> M STY 1 1 SUP<br /> M SLB 1 1 1<br /> M SAL 1 2 30 31<br /> M SBL 1 1 32<br /> M SMT 1 OCH3<br /> M SVB 1 32 -2.5118 -0.043<br /> S SKP 8<br /> ID FL5FFCNSS002<br /> KNApSAcK_ID C00006077<br /> NAME Gossypetin 7,8-dimethyl ether 3,3'-disulfate;2-[4-Hydroxy-3-(sulfooxy)phenyl]-5-hydroxy-7,8-dimethoxy-3-(sulfooxy)-4H-1-benzopyran-4-one<br /> CAS_RN 164163-87-5<br /> FORMULA C17H14O14S2<br /> EXACTMASS 505.982496536<br /> AVERAGEMASS 506.41666000000004<br /> SMILES COc(c3)c(OC)c(O1)c(c(O)3)C(=O)C(OS(O)(=O)=O)=C1c(c2)cc(c(O)c2)OS(O)(=O)=O<br /> M END<br /> &lt;/pre&gt;</div>

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