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Mol:FL3FAICS0004 - Revision history
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Copyright: ARM project http://www.metabolome.jp/<br />
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M STY 1 1 SUP<br />
M SLB 1 1 1<br />
M SAL 1 2 39 40<br />
M SBL 1 1 44<br />
M SMT 1 CH2OH<br />
M SBV 1 44 -0.4515 -0.5696<br />
M STY 1 2 SUP<br />
M SLB 1 2 2<br />
M SAL 2 2 41 42<br />
M SBL 2 1 46<br />
M SMT 2 OCH3<br />
M SBV 2 46 -0.3762 -0.7470<br />
M STY 1 3 SUP<br />
M SLB 1 3 3<br />
M SAL 3 2 43 44<br />
M SBL 3 1 48<br />
M SMT 3 OCH3<br />
M SBV 3 48 -1.1122 0.6422<br />
S SKP 5<br />
ID FL3FAICS0004<br />
FORMULA C28H32O16<br />
EXACTMASS 624.1690349759999<br />
AVERAGEMASS 624.54408<br />
SMILES OC(C1c(c53)c(O)c(c(O)c3C(=O)C=C(O5)c(c4)cc(OC)c(O)c(OC)4)C(C(O)2)OCC(O)C2O)C(O)C(C(O1)CO)O<br />
M END<br />
</pre></div>
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