Mol:FL3FBCGS0002
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/
42 46 0 0 0 0 0 0 0 0999 V2000
4.0677 1.4973 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.0677 0.6723 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.7822 0.2598 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4967 0.6723 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4967 1.4973 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.7822 1.9098 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.3533 0.2598 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6388 0.6723 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.9243 0.2598 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9243 -0.5652 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6388 -0.9777 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.3533 -0.5652 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2099 0.6723 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4954 0.2598 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4954 -0.5652 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2099 -0.9777 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6388 -1.6960 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.2191 0.6723 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.2099 -1.6636 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
6.2023 1.8988 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
6.0712 0.3406 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-5.6420 2.0766 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.2295 1.3621 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.4314 1.5712 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.6382 1.3444 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.0506 2.0589 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-4.8487 1.8499 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.0620 1.0412 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-5.8369 1.3685 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-6.2023 1.7826 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.8865 1.1361 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4740 0.4216 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6759 0.6307 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8827 0.4039 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.2951 1.1184 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.0932 0.9094 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5375 1.4319 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.1190 1.5630 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.3887 0.9404 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.0655 0.3904 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.2260 0.1251 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.4946 -2.0766 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1 2 2 0 0 0 0
2 3 1 0 0 0 0
3 4 2 0 0 0 0
4 5 1 0 0 0 0
5 6 2 0 0 0 0
6 1 1 0 0 0 0
2 7 1 0 0 0 0
7 8 1 0 0 0 0
8 9 1 0 0 0 0
9 10 2 0 0 0 0
10 11 1 0 0 0 0
11 12 1 0 0 0 0
12 7 2 0 0 0 0
9 13 1 0 0 0 0
13 14 2 0 0 0 0
14 15 1 0 0 0 0
15 16 2 0 0 0 0
16 10 1 0 0 0 0
14 18 1 0 0 0 0
11 17 2 0 0 0 0
16 19 1 0 0 0 0
5 20 1 0 0 0 0
4 21 1 0 0 0 0
22 23 1 1 0 0 0
23 24 1 1 0 0 0
25 24 1 1 0 0 0
25 26 1 0 0 0 0
26 27 1 0 0 0 0
27 22 1 0 0 0 0
24 28 1 0 0 0 0
23 29 1 0 0 0 0
22 30 1 0 0 0 0
31 32 1 1 0 0 0
32 33 1 1 0 0 0
34 33 1 1 0 0 0
34 35 1 0 0 0 0
35 36 1 0 0 0 0
36 31 1 0 0 0 0
36 37 1 0 0 0 0
37 38 1 0 0 0 0
31 39 1 0 0 0 0
32 40 1 0 0 0 0
33 41 1 0 0 0 0
34 18 1 0 0 0 0
25 38 1 0 0 0 0
19 42 1 0 0 0 0
S SKP 5
ID FL3FBCGS0002
FORMULA C27H30O15
EXACTMASS 594.15847029
AVERAGEMASS 594.5181
SMILES c(c5O)c(ccc5O)C(O4)=CC(=O)c(c43)c(cc(c3)OC(C1O)OC(COC(O2)C(O)C(C(O)C2)O)C(O)C(O)1)OC
M END
