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Mol:FL5FGCGA0001 - Revision history
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2009-03-14T00:00:00Z
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Copyright: ARM project http://www.metabolome.jp/<br />
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12 13 2 0 0 0 0<br />
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16 44 1 0 0 0 0<br />
46 47 1 0 0 0 0<br />
6 46 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 -0.0934 0.7884<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 0.6758 0.3864<br />
M STY 1 3 SUP<br />
M SLB 1 3 3<br />
M SAL 3 2 44 45<br />
M SBL 3 1 49<br />
M SMT 3 OCH3<br />
M SBV 3 49 -0.0149 -0.6768<br />
M STY 1 4 SUP<br />
M SLB 1 4 4<br />
M SAL 4 2 46 47<br />
M SBL 4 1 51<br />
M SMT 4 OCH3<br />
M SBV 4 51 -0.0285 -0.6727<br />
S SKP 5<br />
ID FL5FGCGA0001<br />
FORMULA C29H34O18<br />
EXACTMASS 670.174514284<br />
AVERAGEMASS 670.5694599999999<br />
SMILES C(C1O)(OC(C(=O)4)=C(Oc(c5OC)c(c(c(c5O)OC)O)4)c(c3)ccc(c3OC)O)OC(C(O)C(OC(O2)C(C(O)C(O)C2)O)1)CO<br />
M END<br />
</pre></div>
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