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Mol:FL2FABGS0001 - Revision history
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Copyright: ARM project http://www.metabolome.jp/<br />
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11 12 2 0 0 0 0<br />
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13 14 2 0 0 0 0<br />
14 15 1 0 0 0 0<br />
15 16 2 0 0 0 0<br />
16 11 1 0 0 0 0<br />
9 17 1 1 0 0 0<br />
3 18 1 0 0 0 0<br />
1 19 1 0 0 0 0<br />
19 20 1 0 0 0 0<br />
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20 24 1 0 0 0 0<br />
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34 26 1 0 0 0 0<br />
40 41 1 0 0 0 0<br />
25 40 1 0 0 0 0<br />
42 43 1 0 0 0 0<br />
14 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 0.5627 -0.4490<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 -0.7130 -0.4116<br />
S SKP 5<br />
ID FL2FABGS0001<br />
FORMULA C28H33HO14<br />
EXACTMASS 594.194855796<br />
AVERAGEMASS 594.56116<br />
SMILES c(OC)(c1)ccc(C(O5)(CC(=O)c(c52)c(cc(OC(C3OC(O4)C(O)C(C(C4C)O)O)OC(C(C3O)O)CO)c2)O)[H])c1<br />
M END<br />
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