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Mol:FL5FAAGS0034 - Revision history
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Copyright: ARM project http://www.metabolome.jp/<br />
41 45 0 0 0 0 0 0 0 0999 V2000<br />
0.8028 1.2348 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br />
0.8028 0.4951 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br />
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-3.9699 -1.7578 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br />
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-2.6150 -1.6966 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br />
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-5.9637 -1.5348 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br />
1 2 1 0 0 0 0<br />
2 3 2 0 0 0 0<br />
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4 5 2 0 0 0 0<br />
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6 1 2 0 0 0 0<br />
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7 8 1 0 0 0 0<br />
8 9 2 0 0 0 0<br />
9 10 1 0 0 0 0<br />
10 5 1 0 0 0 0<br />
7 11 2 0 0 0 0<br />
9 12 1 0 0 0 0<br />
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 />
17 12 1 0 0 0 0<br />
3 18 1 0 0 0 0<br />
1 19 1 0 0 0 0<br />
15 20 1 0 0 0 0<br />
8 21 1 0 0 0 0<br />
22 23 1 1 0 0 0<br />
23 24 1 1 0 0 0<br />
25 24 1 1 0 0 0<br />
25 26 1 0 0 0 0<br />
26 27 1 0 0 0 0<br />
27 22 1 0 0 0 0<br />
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23 29 1 0 0 0 0<br />
24 30 1 0 0 0 0<br />
31 32 1 1 0 0 0<br />
32 33 1 1 0 0 0<br />
34 33 1 1 0 0 0<br />
34 35 1 0 0 0 0<br />
35 36 1 0 0 0 0<br />
36 31 1 0 0 0 0<br />
31 37 1 0 0 0 0<br />
32 38 1 0 0 0 0<br />
33 39 1 0 0 0 0<br />
34 28 1 0 0 0 0<br />
25 19 1 0 0 0 0<br />
40 41 1 0 0 0 0<br />
36 40 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 0.8432 -0.1796<br />
S SKP 5<br />
ID FL5FAAGS0034<br />
FORMULA C26H28O15<br />
EXACTMASS 580.1428202259999<br />
AVERAGEMASS 580.49152<br />
SMILES Oc(c5)ccc(c5)C(=C(O)1)Oc(c2)c(c(O)cc2OC(C(O)4)OCC(C4O)OC(O3)C(C(C(C3CO)O)O)O)C1=O<br />
M END<br />
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