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Mol:FL3FCEGS0002 - Revision history
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Copyright: ARM project http://www.metabolome.jp/<br />
43 47 0 0 0 0 0 0 0 0999 V2000<br />
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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 />
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16 18 1 0 0 0 0<br />
3 19 1 0 0 0 0<br />
20 21 1 1 0 0 0<br />
21 22 1 1 0 0 0<br />
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25 29 1 0 0 0 0<br />
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30 31 1 1 0 0 0<br />
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31 37 1 0 0 0 0<br />
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39 33 1 0 0 0 0<br />
40 41 1 0 0 0 0<br />
1 40 1 0 0 0 0<br />
42 43 1 0 0 0 0<br />
15 42 1 0 0 0 0<br />
M STY 1 1 SUP<br />
M SLB 1 1 1<br />
M SAL 1 2 40 41<br />
M SBL 1 1 45<br />
M SMT 1 ^ OCH3<br />
M SBV 1 45 0.5539 -0.9592<br />
M STY 1 2 SUP<br />
M SLB 1 2 2<br />
M SAL 2 2 42 43<br />
M SBL 2 1 47<br />
M SMT 2 OCH3<br />
M SBV 2 47 -0.9150 -0.5283<br />
S SKP 5<br />
ID FL3FCEGS0002<br />
FORMULA C28H32O15<br />
EXACTMASS 608.174120354<br />
AVERAGEMASS 608.54468<br />
SMILES COc(c3)cc(O1)c(c3OC(C(O)5)OC(C(O)C(O)5)COC(O4)C(O)C(O)C(C4)O)C(C=C(c(c2)ccc(c2O)OC)1)=O<br />
M END<br />
</pre></div>
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