Mol:FL2FABGS0007
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/
31 34 0 0 0 0 0 0 0 0999 V2000
-1.9992 -1.1368 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.2848 -1.5493 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5703 -1.1368 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5703 -0.3118 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.2848 0.1006 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9992 -0.3118 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1440 -1.5493 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8584 -1.1368 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8584 -0.3118 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1440 0.1006 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.1440 -2.2678 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.2848 -2.3734 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.6942 0.0894 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.6535 0.0988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3787 -0.3198 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.1040 0.0988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.1040 0.9362 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3787 1.3549 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6535 0.9362 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.1607 0.2695 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.4402 -0.1464 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.6688 0.6534 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.4402 1.4580 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.1607 1.8740 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.9322 1.0742 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.8441 2.3734 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.4402 1.9771 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.5801 1.2478 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-4.8090 0.2700 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.8291 1.3549 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.8090 0.7891 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
3 7 1 0 0 0 0
7 8 1 0 0 0 0
8 9 1 0 0 0 0
9 10 1 0 0 0 0
10 4 1 0 0 0 0
7 11 2 0 0 0 0
2 12 1 0 0 0 0
6 13 1 0 0 0 0
9 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 18 1 0 0 0 0
18 19 2 0 0 0 0
19 14 1 0 0 0 0
21 20 1 1 0 0 0
21 22 1 0 0 0 0
22 23 1 0 0 0 0
23 24 1 0 0 0 0
24 25 1 1 0 0 0
25 20 1 1 0 0 0
24 26 1 0 0 0 0
23 27 1 0 0 0 0
25 28 1 0 0 0 0
20 29 1 0 0 0 0
21 13 1 0 0 0 0
30 31 1 0 0 0 0
17 30 1 0 0 0 0
M STY 1 1 SUP
M SLB 1 1 1
M SAL 1 2 30 31
M SBL 1 1 34
M SMT 1 OCH3
M SBV 1 34 -0.7252 -0.4187
S SKP 5
ID FL2FABGS0007
FORMULA C22H24O9
EXACTMASS 432.14203236599997
AVERAGEMASS 432.42056
SMILES c(c1C(O2)CC(c(c4O)c(cc(c4)OC(C3O)OC(C(O)C3O)C)2)=O)cc(OC)cc1
M END
