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Mol:FL3FADGS0016 - 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 />
M STY 1 1 SUP<br />
M SLB 1 1 1<br />
M SAL 1 3 40 41 42<br />
M SBL 1 1 46<br />
M SMT 1 ^ COOH<br />
M SBV 1 46 0.5329 -0.5749<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 -0.6896<br />
S SKP 5<br />
ID FL3FADGS0016<br />
FORMULA C28H30O16<br />
EXACTMASS 622.153384912<br />
AVERAGEMASS 622.5282<br />
SMILES OC(C(C(O)=O)1)C(C(C(Oc(c2)cc(O)c(C5=O)c2OC(=C5)c(c3)cc(c(OC(O4)C(O)C(C(O)C(C)4)O)c3)OC)O1)O)O<br />
M END<br />
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