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Mol:FLNACCGS0004 - 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 />
0.8879 1.3542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br />
1.6073 1.7695 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br />
2.3265 1.3544 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br />
2.3265 0.4931 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br />
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3.8182 1.3544 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br />
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-3.3792 -0.2657 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0<br />
-4.5634 -0.2214 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br />
-4.2007 -0.6921 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br />
-2.2902 -0.9281 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br />
0.4259 2.1544 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0<br />
-0.2205 3.2744 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 7 1 0 0 0 0<br />
7 8 1 0 0 0 0<br />
8 3 1 0 0 0 0<br />
1 9 1 0 0 0 0<br />
9 10 2 0 0 0 0<br />
10 4 1 0 0 0 0<br />
5 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 />
7 17 2 0 0 0 0<br />
14 18 1 0 0 0 0<br />
10 19 1 0 0 0 0<br />
20 21 1 1 0 0 0<br />
21 22 1 1 0 0 0<br />
23 22 1 1 0 0 0<br />
23 24 1 0 0 0 0<br />
24 25 1 0 0 0 0<br />
25 20 1 0 0 0 0<br />
20 26 1 0 0 0 0<br />
21 27 1 0 0 0 0<br />
22 28 1 0 0 0 0<br />
25 29 1 0 0 0 0<br />
23 19 1 0 0 0 0<br />
29 30 1 0 0 0 0<br />
15 31 1 0 0 0 0<br />
32 33 1 1 0 0 0<br />
33 34 1 1 0 0 0<br />
35 34 1 1 0 0 0<br />
35 36 1 0 0 0 0<br />
36 37 1 0 0 0 0<br />
37 32 1 0 0 0 0<br />
32 38 1 0 0 0 0<br />
33 39 1 0 0 0 0<br />
34 40 1 0 0 0 0<br />
35 30 1 0 0 0 0<br />
41 42 1 0 0 0 0<br />
1 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 ^ OCH3<br />
M SBV 1 46 0.4619 -0.8002<br />
S SKP 5<br />
ID FLNACCGS0004<br />
FORMULA C27H30O15<br />
EXACTMASS 594.15847029<br />
AVERAGEMASS 594.5181<br />
SMILES C(Oc(c43)cc(OC)cc3OC(C=C(c(c5)cc(O)c(O)c5)4)=O)(C(O)2)OC(C(O)C2O)COC(O1)C(O)C(C(O)C1)O<br />
M END<br />
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