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Mol:FL7AACGL0012 - 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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6 1 2 0 0 0 0<br />
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7 8 2 0 0 0 0<br />
8 9 1 0 0 0 0<br />
9 10 2 0 0 0 0<br />
10 5 1 0 0 0 0<br />
9 11 1 0 0 0 0<br />
11 12 2 0 0 0 0<br />
12 13 1 0 0 0 0<br />
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 />
14 17 1 0 0 0 0<br />
1 18 1 0 0 0 0<br />
3 19 1 0 0 0 0<br />
15 20 1 0 0 0 0<br />
22 23 1 0 0 0 0<br />
23 24 1 1 0 0 0<br />
24 25 1 1 0 0 0<br />
26 25 1 1 0 0 0<br />
26 27 1 0 0 0 0<br />
27 22 1 0 0 0 0<br />
22 28 1 0 0 0 0<br />
27 29 1 0 0 0 0<br />
26 30 1 0 0 0 0<br />
23 21 1 0 0 0 0<br />
21 8 1 0 0 0 0<br />
32 31 1 1 0 0 0<br />
32 33 1 0 0 0 0<br />
33 34 1 0 0 0 0<br />
34 35 1 0 0 0 0<br />
35 36 1 1 0 0 0<br />
36 31 1 1 0 0 0<br />
35 37 1 0 0 0 0<br />
34 38 1 0 0 0 0<br />
36 39 1 0 0 0 0<br />
31 40 1 0 0 0 0<br />
32 18 1 0 0 0 0<br />
41 42 1 0 0 0 0<br />
25 41 1 0 0 0 0<br />
M CHG 1 10 1<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 -0.6461 0.6569<br />
S SKP 5<br />
ID FL7AACGL0012<br />
FORMULA C27H31O15<br />
EXACTMASS 595.166295322<br />
AVERAGEMASS 595.52604<br />
SMILES Oc(c(O)5)ccc(c5)c(c3OC(O4)C(C(O)C(C4CO)O)O)[o+1]c(c1c3)cc(OC(O2)C(O)C(O)C(O)C2C)cc1O<br />
M END<br />
</pre></div>
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