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Mol:FL3FABGS0006 - Revision history
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Copyright: ARM project http://www.metabolome.jp/<br />
42 46 0 0 0 0 0 0 0 0999 V2000<br />
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10 5 1 0 0 0 0<br />
7 11 2 0 0 0 0<br />
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12 13 2 0 0 0 0<br />
13 14 1 0 0 0 0<br />
14 15 2 0 0 0 0<br />
15 16 1 0 0 0 0<br />
16 17 2 0 0 0 0<br />
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1 18 1 0 0 0 0<br />
19 3 1 0 0 0 0<br />
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24 25 1 0 0 0 0<br />
25 20 1 0 0 0 0<br />
20 26 1 0 0 0 0<br />
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30 31 1 1 0 0 0<br />
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23 18 1 0 0 0 0<br />
39 40 1 0 0 0 0<br />
25 39 1 0 0 0 0<br />
41 42 1 0 0 0 0<br />
15 41 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 ^CH2OH<br />
M SBV 1 44 0.5783 -0.6006<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 OCH3<br />
M SBV 2 46 -0.7142 -0.4123<br />
S SKP 5<br />
ID FL3FABGS0006<br />
FORMULA C28H32O14<br />
EXACTMASS 592.179205732<br />
AVERAGEMASS 592.54528<br />
SMILES O(C)c(c5)ccc(c5)C(=C4)Oc(c3C4=O)cc(cc3O)OC(O2)C(C(C(O)C2CO)O)OC(O1)C(O)C(C(C1C)O)O<br />
M END<br />
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