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Mol:FL3FACDS0006 - 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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10 5 1 0 0 0 0<br />
7 11 2 0 0 0 0<br />
3 12 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 17 1 0 0 0 0<br />
17 18 2 0 0 0 0<br />
18 13 1 0 0 0 0<br />
9 13 1 0 0 0 0<br />
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1 20 1 0 0 0 0<br />
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15 30 1 0 0 0 0<br />
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35 36 1 0 0 0 0<br />
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34 20 1 0 0 0 0<br />
40 41 1 0 0 0 0<br />
36 40 1 0 0 0 0<br />
42 43 1 0 0 0 0<br />
26 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 ^ CH2OH<br />
M SBV 1 45 0.6184 -0.6675<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 ^ CH2OH<br />
M SBV 2 47 0.9230 -0.5247<br />
S SKP 5<br />
ID FL3FACDS0006<br />
FORMULA C27H30O16<br />
EXACTMASS 610.153384912<br />
AVERAGEMASS 610.5175<br />
SMILES C(c(c5O)c(cc(c45)OC(=CC4=O)c(c3)ccc(O)c3O)OC(C2O)OC(C(O)C2O)CO)(C(O)1)OC(C(O)C(O)1)CO<br />
M END<br />
</pre></div>
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