Mol:FL2F1AGSN001
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/
50 56 0 0 0 0 0 0 0 0999 V2000
-3.4082 1.6817 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.6956 2.0974 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.4050 0.8567 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.6883 0.4474 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9756 0.8631 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9793 1.6881 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.2593 0.4537 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5467 0.8694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5503 1.6944 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.2666 2.1037 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.1034 2.0752 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8195 1.6655 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.5324 2.0807 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.5292 2.9057 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8131 3.3155 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1002 2.9002 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.2593 -0.2407 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-4.0337 2.0428 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.2365 3.3141 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.8737 0.6816 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6899 0.8040 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.7874 1.6235 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2889 2.2789 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4727 2.1566 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.3751 1.3371 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7439 1.1860 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4484 0.6742 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.8737 0.0098 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.3748 0.2582 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.6414 1.8048 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.8224 -1.1548 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.0888 -1.6162 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.0337 -0.6917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.3114 -0.6209 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.6652 0.1971 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3096 -1.1585 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.6596 -0.3176 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8050 -0.2974 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.6408 -1.0827 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.9602 -0.6702 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.9602 -0.0123 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.3232 -1.0890 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3500 -0.6122 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0116 -1.1051 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
-0.7472 -1.8867 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0777 -1.8767 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1511 -2.6060 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7300 -3.3155 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0950 -3.3056 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4988 -2.5862 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1 2 2 0 0 0 0
1 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 2 1 0 0 0 0
5 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 6 1 0 0 0 0
9 11 1 6 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
1 18 1 0 0 0 0
14 19 1 0 0 0 0
20 21 1 1 0 0 0
21 22 1 1 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 20 1 0 0 0 0
25 26 1 0 0 0 0
26 27 1 0 0 0 0
20 28 1 0 0 0 0
21 29 1 0 0 0 0
22 30 1 0 0 0 0
23 19 1 0 0 0 0
37 31 1 1 0 0 0
36 31 1 1 0 0 0
35 37 1 1 0 0 0
31 32 1 0 0 0 0
37 33 1 0 0 0 0
38 35 1 0 0 0 0
34 39 1 0 0 0 0
36 38 1 0 0 0 0
31 34 1 0 0 0 0
30 35 1 0 0 0 0
39 40 1 0 0 0 0
40 41 2 0 0 0 0
40 42 1 0 0 0 0
42 43 2 0 0 0 0
43 44 1 0 0 0 0
44 45 1 0 0 0 0
45 46 2 0 0 0 0
46 42 1 0 0 0 0
45 47 1 0 0 0 0
47 48 2 0 0 0 0
48 49 1 0 0 0 0
49 50 2 0 0 0 0
50 46 1 0 0 0 0
S SKP 5
ID FL2F1AGSN001
FORMULA C35H35NO14
EXACTMASS 693.205754833
AVERAGEMASS 693.65074
SMILES c(OC(O4)C(OC(O5)C(O)C(COC(=O)c(c76)cnc6cccc7)(C5)O)C(C(C4CO)O)O)(c1)ccc(C(O2)CC(c(c3)c2cc(c3)O)=O)c1
M END
