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Mol:FL5FFCGS0018 - Revision history
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Copyright: ARM project http://www.metabolome.jp/<br />
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16 43 1 0 0 0 0<br />
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27 45 1 0 0 0 0<br />
M STY 1 1 SUP<br />
M SLB 1 1 1<br />
M SAL 1 2 41 42<br />
M SBL 1 1 46<br />
M SMT 1 OCH3<br />
M SBV 1 46 0.0000 -0.7531<br />
M STY 1 2 SUP<br />
M SLB 1 2 2<br />
M SAL 2 2 43 44<br />
M SBL 2 1 48<br />
M SMT 2 OCH3<br />
M SBV 2 48 0.0000 -0.7618<br />
M STY 1 3 SUP<br />
M SLB 1 3 3<br />
M SAL 3 2 45 46<br />
M SBL 3 1 50<br />
M SMT 3 ^ CH2OH<br />
M SBV 3 50 0.5272 -0.4826<br />
S SKP 5<br />
ID FL5FFCGS0018<br />
FORMULA C29H34O17<br />
EXACTMASS 654.179599662<br />
AVERAGEMASS 654.57006<br />
SMILES c(c43)(O)cc(c(c3OC(c(c5)cc(c(O)c5)OC)=C(C4=O)O)OC)OC(O1)C(OC(O2)C(C(C(C2C)O)O)O)C(O)C(C1CO)O<br />
M END<br />
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