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Mol:FL3FADGS0015 - Revision history
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Copyright: ARM project http://www.metabolome.jp/<br />
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43 44 1 0 0 0 0<br />
M STY 1 1 SUP<br />
M SLB 1 1 1<br />
M SAL 1 2 39 40<br />
M SBL 1 1 44<br />
M SMT 1 OCH3<br />
M SBV 1 44 -0.3573 -0.8474<br />
M STY 1 2 SUP<br />
M SLB 1 2 2<br />
M SAL 2 2 41 42<br />
M SBL 2 1 46<br />
M SMT 2 CH2OH<br />
M SBV 2 46 -0.6607 0.3487<br />
M STY 1 3 SUP<br />
M SLB 1 3 3<br />
M SAL 3 2 43 44<br />
M SBL 3 1 47<br />
M SMT 3 ^ CH2OH<br />
M SBV 3 47 0.2405 -1.3599<br />
S SKP 5<br />
ID FL3FADGS0015<br />
FORMULA C28H32O16<br />
EXACTMASS 624.1690349759999<br />
AVERAGEMASS 624.54408<br />
SMILES OC(C5O)C(CO)OC(C5O)Oc(c4)cc(O1)c(c4O)C(C=C(c(c3)ccc(c(OC)3)OC(C(O)2)OC(C(C2O)O)CO)1)=O<br />
M END<br />
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