Mol:FL3FEAGS0013
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/
41 45 0 0 0 0 0 0 0 0999 V2000
-2.3389 -0.3432 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3389 -1.1527 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6380 -1.5573 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.9370 -1.1527 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.9370 -0.3432 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6380 0.0614 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2361 -1.5573 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4649 -1.1527 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4649 -0.3432 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2361 0.0614 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.2361 -2.1884 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.1656 0.0613 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8799 -0.3511 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5943 0.0613 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5943 0.8863 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8799 1.2987 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.1656 0.8863 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.0396 0.0613 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.3085 1.2985 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.6380 -2.1887 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.0384 -1.5564 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-4.4872 0.1907 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.8038 -0.2038 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.0207 0.5549 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.8038 1.3182 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.4872 1.7129 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.2705 0.9541 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.1943 2.1887 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.8024 1.8918 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.8424 1.3443 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-5.0631 0.1378 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.0355 -0.1363 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.7189 -0.5308 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5020 0.2279 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.7189 0.9912 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.0355 1.3858 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.2522 0.6270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.0631 0.5642 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.1032 -0.8040 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
5.0018 -0.2248 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.4996 -1.2321 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1 2 1 0 0 0 0
2 3 2 0 0 0 0
3 4 1 0 0 0 0
4 5 2 0 0 0 0
5 6 1 0 0 0 0
6 1 2 0 0 0 0
4 7 1 0 0 0 0
7 8 1 0 0 0 0
8 9 2 0 0 0 0
9 10 1 0 0 0 0
10 5 1 0 0 0 0
7 11 2 0 0 0 0
9 12 1 0 0 0 0
12 13 2 0 0 0 0
13 14 1 0 0 0 0
14 15 2 0 0 0 0
15 16 1 0 0 0 0
16 17 2 0 0 0 0
17 12 1 0 0 0 0
1 18 1 0 0 0 0
15 19 1 0 0 0 0
20 3 1 0 0 0 0
2 21 1 0 0 0 0
23 22 1 1 0 0 0
23 24 1 0 0 0 0
24 25 1 0 0 0 0
25 26 1 0 0 0 0
26 27 1 1 0 0 0
27 22 1 1 0 0 0
26 28 1 0 0 0 0
25 29 1 0 0 0 0
27 30 1 0 0 0 0
22 31 1 0 0 0 0
23 18 1 0 0 0 0
33 32 1 1 0 0 0
33 34 1 0 0 0 0
34 35 1 0 0 0 0
35 36 1 0 0 0 0
36 37 1 1 0 0 0
37 32 1 1 0 0 0
37 38 1 0 0 0 0
32 39 1 0 0 0 0
36 19 1 0 0 0 0
34 40 1 0 0 0 0
33 41 1 0 0 0 0
S SKP 5
ID FL3FEAGS0013
FORMULA C27H30O14
EXACTMASS 578.163555668
AVERAGEMASS 578.5187000000001
SMILES c(c4)(c1c(c(O)c4OC(O5)C(C(C(O)C5C)O)O)O)OC(c(c3)ccc(c3)OC(O2)C(O)C(C(C(C)2)O)O)=CC(=O)1
M END
