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Mol:FL3FACDS0025 - 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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5 6 1 0 0 0 0<br />
6 1 2 0 0 0 0<br />
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7 8 2 0 0 0 0<br />
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9 10 2 0 0 0 0<br />
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8 11 1 0 0 0 0<br />
10 12 1 0 0 0 0<br />
5 13 2 0 0 0 0<br />
1 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 />
17 18 1 0 0 0 0<br />
18 19 2 0 0 0 0<br />
19 14 1 0 0 0 0<br />
17 20 1 0 0 0 0<br />
21 9 1 0 0 0 0<br />
22 23 1 1 0 0 0<br />
23 24 1 1 0 0 0<br />
25 26 1 0 0 0 0<br />
26 22 1 0 0 0 0<br />
22 27 1 0 0 0 0<br />
23 28 1 0 0 0 0<br />
24 29 1 0 0 0 0<br />
16 30 1 0 0 0 0<br />
21 24 1 1 0 0 0<br />
21 25 1 0 0 0 0<br />
31 32 1 0 0 0 0<br />
32 33 1 1 0 0 0<br />
34 33 1 1 0 0 0<br />
35 34 1 1 0 0 0<br />
35 36 1 0 0 0 0<br />
36 31 1 0 0 0 0<br />
34 37 1 0 0 0 0<br />
33 38 1 0 0 0 0<br />
32 39 1 0 0 0 0<br />
31 40 1 0 0 0 0<br />
35 11 1 0 0 0 0<br />
41 42 1 0 0 0 0<br />
26 41 1 0 0 0 0<br />
M STY 1 1 SUP<br />
M SLB 1 1 1<br />
M SAL 1 2 41 42<br />
M SBL 1 1 46<br />
M SMT 1 ^ CH2OH<br />
M SBV 1 46 0.6300 -0.6300<br />
S SKP 5<br />
ID FL3FACDS0025<br />
FORMULA C27H30O15<br />
EXACTMASS 594.15847029<br />
AVERAGEMASS 594.5181<br />
SMILES C(C5C)(O)C(O)C(O)C(O5)Oc(c2)c(c(c(C(=O)4)c2OC(=C4)c(c3)ccc(O)c3O)O)C(C(O)1)OC(C(O)C(O)1)CO<br />
M END<br />
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