Mol:FL2FEGGS0001
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/
38 41 0 0 0 0 0 0 0 0999 V2000
-2.2798 0.3443 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.2798 -0.4778 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5677 -0.8890 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8556 -0.4778 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8556 0.3443 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5677 0.7555 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1435 -0.8890 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5686 -0.4778 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5686 0.3443 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1435 0.7555 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.2804 0.7553 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0060 0.3363 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.7318 0.7553 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.7318 1.5934 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0060 2.0123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2804 1.5934 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1435 -1.5851 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.5677 -1.7110 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.1674 -2.5724 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.5957 -3.3141 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.7721 -3.0787 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9436 -3.2958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5153 -2.5542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3389 -2.7895 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.8743 -2.5978 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.2714 -3.1120 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.1514 -3.6363 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.9423 -3.8930 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.2174 0.2836 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.1320 -0.2444 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.9626 0.7432 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.6026 1.8517 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0017 2.7359 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.5491 3.8930 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2436 2.0258 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.3521 2.6659 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.0898 -0.8407 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-4.3521 -0.6280 0.0000 C 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 1 0 0 0 0
9 10 1 0 0 0 0
10 5 1 0 0 0 0
9 11 1 0 0 0 0
11 12 2 0 0 0 0
12 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 11 1 0 0 0 0
7 17 2 0 0 0 0
3 18 1 0 0 0 0
19 20 1 0 0 0 0
20 21 1 1 0 0 0
22 21 1 1 0 0 0
23 22 1 1 0 0 0
23 24 1 0 0 0 0
24 19 1 0 0 0 0
18 23 1 0 0 0 0
19 25 1 0 0 0 0
20 26 1 0 0 0 0
21 27 1 0 0 0 0
22 28 1 0 0 0 0
29 30 1 0 0 0 0
13 29 1 0 0 0 0
31 32 1 0 0 0 0
1 31 1 0 0 0 0
33 34 1 0 0 0 0
15 33 1 0 0 0 0
35 36 1 0 0 0 0
14 35 1 0 0 0 0
37 38 1 0 0 0 0
2 37 1 0 0 0 0
M STY 1 1 SUP
M SLB 1 1 1
M SAL 1 2 29 30
M SBL 1 1 33
M SMT 1 OCH3
M SBV 1 33 -0.4856 0.4717
M STY 1 2 SUP
M SLB 1 2 2
M SAL 2 2 31 32
M SBL 2 1 35
M SMT 2 ^ OCH3
M SBV 2 35 0.6829 -0.3988
M STY 1 3 SUP
M SLB 1 3 3
M SAL 3 2 33 34
M SBL 3 1 37
M SMT 3 OCH3
M SBV 3 37 0.0043 -0.7235
M STY 1 4 SUP
M SLB 1 4 4
M SAL 4 2 35 36
M SBL 4 1 39
M SMT 4 OCH3
M SBV 4 39 -0.5118 -0.4324
M STY 1 5 SUP
M SLB 1 5 5
M SAL 5 2 37 38
M SBL 5 1 41
M SMT 5 ^ OCH3
M SBV 5 41 0.8101 0.3629
S SKP 5
ID FL2FEGGS0001
FORMULA C26H32O12
EXACTMASS 536.189376488
AVERAGEMASS 536.5250799999999
SMILES c(c4)(cc(OC)c(OC)c4OC)C(C3)Oc(c1)c(C3=O)c(OC(C(O)2)OC(C)C(O)C2O)c(OC)c1OC
M END
