http://metabolomics.jp/mediawiki/index.php?action=history&feed=atom&title=Mol%3AFL7AAAGL0018 2026-05-17T15:35:58Z Revision history for this page on the wiki MediaWiki 1.19.1 http://metabolomics.jp/mediawiki/index.php?title=Mol:FL7AAAGL0018&diff=192111&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 /> 43 47 0 0 0 0 0 0 0 0999 V2000<br /> -4.4579 1.2141 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -4.4579 0.5718 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -3.9016 0.2506 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -3.3453 0.5718 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -3.3453 1.2141 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -3.9016 1.5353 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -2.7890 0.2506 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -2.2327 0.5718 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -2.2327 1.2141 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -2.7890 1.5353 0.0000 O 0 3 0 0 0 0 0 0 0 0 0 0<br /> -1.6766 1.5352 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -1.1097 1.2078 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -0.5427 1.5352 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -0.5427 2.1899 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -1.1097 2.5172 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -1.6766 2.1899 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -5.0140 1.5352 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> 0.0241 2.5171 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> -3.9016 -0.3916 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> -1.8166 -0.1489 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> -0.3138 -0.1727 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -0.5820 -0.6373 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -0.0662 -0.4899 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> 0.4527 -0.6373 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 0.7210 -0.1727 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 0.2052 -0.3201 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> -0.8119 -0.3062 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> 0.3469 0.2087 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> 1.1282 -0.1727 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> 1.0024 -0.4900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 1.2005 -1.2009 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> 1.7755 -1.5328 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 1.4797 -2.0452 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> 2.2625 -1.5290 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 2.5719 -2.0034 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 3.2348 -2.0034 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 3.5314 -2.5172 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 4.1248 -2.5172 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 4.4214 -2.0034 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 4.1248 -1.4896 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 3.5314 -1.4896 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br /> 5.0140 -2.0034 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br /> 4.4211 -0.9763 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 2 0 0 0 0<br /> 8 9 1 0 0 0 0<br /> 9 10 2 0 0 0 0<br /> 10 5 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 /> 1 17 1 0 0 0 0<br /> 14 18 1 0 0 0 0<br /> 3 19 1 0 0 0 0<br /> 20 8 1 0 0 0 0<br /> 21 22 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 21 1 0 0 0 0<br /> 21 27 1 0 0 0 0<br /> 26 28 1 0 0 0 0<br /> 25 29 1 0 0 0 0<br /> 22 20 1 0 0 0 0<br /> 24 30 1 0 0 0 0<br /> 30 31 1 0 0 0 0<br /> 31 32 1 0 0 0 0<br /> 32 33 2 0 0 0 0<br /> 32 34 1 0 0 0 0<br /> 34 35 2 0 0 0 0<br /> 35 36 1 0 0 0 0<br /> 36 37 2 0 0 0 0<br /> 37 38 1 0 0 0 0<br /> 38 39 2 0 0 0 0<br /> 39 40 1 0 0 0 0<br /> 40 41 2 0 0 0 0<br /> 41 36 1 0 0 0 0<br /> 39 42 1 0 0 0 0<br /> 40 43 1 0 0 0 0<br /> S SKP 8<br /> ID FL7AAAGL0018<br /> KNApSAcK_ID C00006757<br /> NAME Pelargonidin 3-(6''-caffeylglucoside)<br /> CAS_RN -<br /> FORMULA C30H27O13<br /> EXACTMASS 595.14516595<br /> AVERAGEMASS 595.5275800000001<br /> SMILES OC(C(Oc(c(c(c5)ccc(O)c5)3)cc(c4O)c(cc(O)c4)[o+1]3)1)C(O)C(O)C(COC(=O)C=Cc(c2)ccc(O)c2O)O1<br /> M END<br /> &lt;/pre&gt;</div>

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