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Mol:FL5FCDGS0002 - Revision history
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Copyright: ARM project http://www.metabolome.jp/<br />
44 48 0 0 0 0 0 0 0 0999 V2000<br />
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1.4283 1.6547 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br />
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2.8572 4.1297 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br />
1 2 2 0 0 0 0<br />
2 3 1 0 0 0 0<br />
3 4 2 0 0 0 0<br />
4 5 1 0 0 0 0<br />
5 6 2 0 0 0 0<br />
6 1 1 0 0 0 0<br />
2 7 1 0 0 0 0<br />
7 8 1 0 0 0 0<br />
8 9 1 0 0 0 0<br />
9 10 2 0 0 0 0<br />
10 11 1 0 0 0 0<br />
11 12 1 0 0 0 0<br />
12 7 2 0 0 0 0<br />
9 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 10 1 0 0 0 0<br />
11 17 2 0 0 0 0<br />
12 18 1 0 0 0 0<br />
16 19 1 0 0 0 0<br />
5 20 1 0 0 0 0<br />
26 21 1 1 0 0 0<br />
25 21 1 1 0 0 0<br />
24 26 1 1 0 0 0<br />
26 22 1 0 0 0 0<br />
27 24 1 0 0 0 0<br />
25 27 1 0 0 0 0<br />
21 23 1 0 0 0 0<br />
25 28 1 0 0 0 0<br />
28 29 1 0 0 0 0<br />
18 24 1 0 0 0 0<br />
30 31 1 1 0 0 0<br />
31 32 1 1 0 0 0<br />
33 32 1 1 0 0 0<br />
33 34 1 0 0 0 0<br />
34 35 1 0 0 0 0<br />
35 30 1 0 0 0 0<br />
30 36 1 0 0 0 0<br />
31 37 1 0 0 0 0<br />
32 38 1 0 0 0 0<br />
33 29 1 0 0 0 0<br />
39 40 1 0 0 0 0<br />
14 39 1 0 0 0 0<br />
41 42 1 0 0 0 0<br />
35 41 1 0 0 0 0<br />
43 44 1 0 0 0 0<br />
4 43 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 ^ OCH3<br />
M SBV 1 44 0.7145 -0.4125<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 ^ CH2OH<br />
M SBV 2 46 0.6658 -0.3844<br />
M STY 1 3 SUP<br />
M SLB 1 3 3<br />
M SAL 3 2 43 44<br />
M SBL 3 1 48<br />
M SMT 3 OCH3<br />
M SBV 3 48 0.0000 -0.8250<br />
S SKP 5<br />
ID FL5FCDGS0002<br />
FORMULA C28H32O16<br />
EXACTMASS 624.1690349759999<br />
AVERAGEMASS 624.54408<br />
SMILES C(=C(OC(C(O)4)OC(COC(C(O)5)OC(CO)C(O)C5O)C(O)4)1)(c(c3)ccc(O)c3OC)Oc(c2)c(c(cc(OC)2)O)C1=O<br />
M END<br />
</pre></div>
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