Mol:FL5FECGS0062
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/
45 49 0 0 0 0 0 0 0 0999 V2000
2.1179 1.3752 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4034 1.7877 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4034 2.6127 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1179 3.0252 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8323 2.6127 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8323 1.7877 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6889 1.3752 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0256 1.7877 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.7400 1.3752 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7400 0.5502 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0256 0.1377 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6889 0.5502 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4545 1.7877 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1690 1.3752 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1690 0.5502 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4545 0.1377 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0256 -0.6873 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.8834 1.7877 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.4034 0.1377 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.4545 -0.6873 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.5468 3.0252 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.1179 3.8502 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.8300 0.1685 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.5468 1.4047 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4047 -1.9692 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4131 -2.0801 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7361 -1.3206 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4010 -0.8318 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5833 -0.7208 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.2601 -1.4803 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3392 -1.4536 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8519 -2.0349 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.7086 -2.6278 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.0650 -2.5460 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.6132 -1.2511 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.3046 -2.8257 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6175 -3.5893 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9236 -2.8230 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5776 -2.3195 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2648 -1.5558 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9586 -2.3222 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.1662 -2.7644 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.1503 -3.7084 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.1573 -3.8502 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.9788 -3.4323 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
12 19 1 0 0 0 0
16 20 1 0 0 0 0
5 21 1 0 0 0 0
4 22 1 0 0 0 0
15 23 1 0 0 0 0
18 24 1 0 0 0 0
25 26 1 1 0 0 0
26 27 1 1 0 0 0
28 27 1 1 0 0 0
28 29 1 0 0 0 0
29 30 1 0 0 0 0
30 25 1 0 0 0 0
30 31 1 0 0 0 0
31 32 1 0 0 0 0
25 33 1 0 0 0 0
26 34 1 0 0 0 0
27 35 1 0 0 0 0
36 37 1 0 0 0 0
37 38 1 1 0 0 0
39 38 1 1 0 0 0
40 39 1 1 0 0 0
40 41 1 0 0 0 0
41 36 1 0 0 0 0
39 42 1 0 0 0 0
38 43 1 0 0 0 0
37 44 1 0 0 0 0
36 45 1 0 0 0 0
40 35 1 0 0 0 0
28 19 1 0 0 0 0
S SKP 5
ID FL5FECGS0062
FORMULA C28H32O17
EXACTMASS 640.163949598
AVERAGEMASS 640.54348
SMILES OC(C5O)C(OC(C)C5O)OC(C1OC(C(=O)3)=C(Oc(c4)c(c(O)c(O)c4OC)3)c(c2)cc(c(c2)O)O)C(O)C(O)C(CO)O1
M END
