http://metabolomics.jp/mediawiki/index.php?action=history&feed=atom&title=Mol%3AFL7AACGL0093 2026-05-18T22:57:00Z Revision history for this page on the wiki MediaWiki 1.19.1 http://metabolomics.jp/mediawiki/index.php?title=Mol:FL7AACGL0093&diff=192455&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 /> 39 42 0 0 0 0 0 0 0 0999 V2000<br /> -3.0400 -0.2548 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -2.4296 0.0976 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -2.4296 0.8025 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -3.0400 1.1550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -3.6505 0.8025 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -3.6505 0.0976 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -1.8191 -0.2548 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -1.2087 0.0976 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -1.2087 0.8025 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -1.8191 1.1550 0.0000 O 0 3 0 0 0 0 0 0 0 0 0 0<br /> -0.6272 1.1382 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -0.0436 0.8013 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 0.5400 1.1382 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 0.5400 1.8121 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -0.0436 2.1490 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -0.6272 1.8121 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 1.1461 2.1620 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> -4.1499 1.0908 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> -3.0400 -0.9153 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> -0.7713 -0.3373 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> -0.0288 2.6987 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> 0.2475 -0.4530 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0<br /> -0.3014 -1.0690 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0<br /> 0.5214 -1.0079 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> 1.2604 -1.3747 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0<br /> 1.8094 -0.7588 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0<br /> 0.9866 -0.8197 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0<br /> -0.2018 -0.5734 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> 1.4314 -0.3750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> 2.7988 -0.6135 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> 2.2604 -1.3747 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 1.7486 -1.7422 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> 2.2221 -2.2157 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 2.6728 -1.7650 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 2.2221 -2.6987 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> 3.1762 -2.2684 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 3.6900 -1.7546 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 3.6900 -1.1607 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> 4.1499 -2.2145 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 /> 2 7 1 0 0 0 0<br /> 7 8 2 0 0 0 0<br /> 8 9 1 0 0 0 0<br /> 9 10 2 0 0 0 0<br /> 10 3 1 0 0 0 0<br /> 9 11 1 0 0 0 0<br /> 11 12 2 0 0 0 0<br /> 12 13 1 0 0 0 0<br /> 13 14 2 0 0 0 0<br /> 14 15 1 0 0 0 0<br /> 15 16 2 0 0 0 0<br /> 16 11 1 0 0 0 0<br /> 14 17 1 0 0 0 0<br /> 5 18 1 0 0 0 0<br /> 1 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 0 0 0 0<br /> 23 24 1 1 0 0 0<br /> 25 24 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 /> 20 23 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 /> 25 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 2 0 0 0 0<br /> 34 36 1 0 0 0 0<br /> 36 37 1 0 0 0 0<br /> 37 38 2 0 0 0 0<br /> 37 39 1 0 0 0 0<br /> M STY 1 1 SUP<br /> M SLB 1 1 1<br /> M SAL 1 3 37 38 39<br /> M SBL 1 1 40<br /> M SMT 1 COOH<br /> M SVB 1 40 3.69 -1.7546<br /> S SKP 8<br /> ID FL7AACGL0093<br /> KNApSAcK_ID C00011083<br /> NAME Cyanidin 3-O-(6''-O-succinyl-beta-glucopyranoside)<br /> CAS_RN 749192-65-2<br /> FORMULA C25H25O14<br /> EXACTMASS 549.124430508<br /> AVERAGEMASS 549.4576<br /> SMILES OC(=O)CCC(OC[C@H]([C@H](O)4)O[C@H](C(C(O)4)O)Oc(c3)c([o+1]c(c32)cc(cc2O)O)c(c1)cc(c(c1)O)O)=O<br /> M END<br /> &lt;/pre&gt;</div>

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