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Mol:FL3FAADS0026 - Revision history
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Copyright: ARM project http://www.metabolome.jp/<br />
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13 14 2 0 0 0 0<br />
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17 18 2 0 0 0 0<br />
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40 41 1 0 0 0 0<br />
25 40 1 0 0 0 0<br />
42 43 2 0 0 0 0<br />
42 44 1 0 0 0 0<br />
36 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 0.6877 -0.5888<br />
M STY 1 2 SUP<br />
M SLB 1 2 2<br />
M SAL 2 3 42 43 44<br />
M SBL 2 1 48<br />
M SMT 2 ^ COOH<br />
M SBV 2 48 0.5640 -0.5716<br />
S SKP 5<br />
ID FL3FAADS0026<br />
FORMULA C27H28O17<br />
EXACTMASS 624.1326494699999<br />
AVERAGEMASS 624.50102<br />
SMILES OCC(O1)C(O)C(O)C(C(c(c2O)c(cc(O3)c(C(C=C3c(c4)cc(OC(C5O)OC(C(O)C5O)C(O)=O)c(c4)O)=O)2)O)1)O<br />
M END<br />
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