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Mol:FL3FEAGS0036 - Revision history
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Copyright: ARM project http://www.metabolome.jp/<br />
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15 38 1 0 0 0 0<br />
40 41 1 0 0 0 0<br />
25 40 1 0 0 0 0<br />
42 43 1 0 0 0 0<br />
1 42 1 0 0 0 0<br />
M STY 1 1 SUP<br />
M SLB 1 1 1<br />
M SAL 1 2 38 39<br />
M SBL 1 1 43<br />
M SMT 1 OCH3<br />
M SBV 1 43 -0.6065 -0.3501<br />
M STY 1 2 SUP<br />
M SLB 1 2 2<br />
M SAL 2 2 40 41<br />
M SBL 2 1 45<br />
M SMT 2 ^ CH2OH<br />
M SBV 2 45 0.8436 -0.6343<br />
M STY 1 3 SUP<br />
M SLB 1 3 3<br />
M SAL 3 2 42 43<br />
M SBL 3 1 47<br />
M SMT 3 ^ OCH3<br />
M SBV 3 47 0.4714 -0.8166<br />
S SKP 5<br />
ID FL3FEAGS0036<br />
FORMULA C28H32O15<br />
EXACTMASS 608.174120354<br />
AVERAGEMASS 608.54468<br />
SMILES C(C(O2)C(O)C(C(C(Oc(c5O)c(OC)cc(c35)OC(c(c4)ccc(OC)c4)=CC3=O)2)OC(O1)C(C(O)C(C1)O)O)O)O<br />
M END<br />
</pre></div>
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