Mol:FL5FACGS0057
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/
45 49 0 0 0 0 0 0 0 0999 V2000
-1.6474 1.4814 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6474 0.6564 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.9329 0.2440 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2183 0.6564 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2183 1.4814 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.9329 1.8939 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4961 0.2440 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2106 0.6564 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2106 1.4814 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4961 1.8939 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.4961 -0.3993 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.1101 2.0526 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8383 1.6323 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.5665 2.0526 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.5665 2.8935 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8383 3.3138 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1101 2.8935 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.9329 -0.5808 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.3458 3.3434 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.3096 2.0641 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.0189 0.1896 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.7701 -2.0284 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4577 -2.4254 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2395 -1.6620 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4577 -0.8938 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.7701 -0.4967 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9881 -1.2603 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.7503 -1.2823 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.8243 -2.7301 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.3727 -3.0313 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.7547 -2.0760 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.0094 -3.5353 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7057 -3.1682 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.0016 -4.2328 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.7567 2.1570 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.0822 1.7676 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.2963 2.5165 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.0822 3.2700 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.7567 3.6595 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.5428 2.9105 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.4901 4.2328 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.1427 3.8784 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.1482 3.3605 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-4.3458 2.1473 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.8383 4.1544 0.0000 O 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
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 2 0 0 0 0
9 10 1 0 0 0 0
10 5 1 0 0 0 0
7 11 2 0 0 0 0
9 12 1 0 0 0 0
12 13 2 0 0 0 0
13 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 12 1 0 0 0 0
3 18 1 0 0 0 0
19 15 1 0 0 0 0
4 3 1 0 0 0 0
1 20 1 0 0 0 0
21 8 1 0 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 26 1 0 0 0 0
26 27 1 1 0 0 0
27 22 1 1 0 0 0
27 28 1 0 0 0 0
22 29 1 0 0 0 0
23 30 1 0 0 0 0
24 31 1 0 0 0 0
26 21 1 0 0 0 0
32 33 2 0 0 0 0
32 34 1 0 0 0 0
36 35 1 1 0 0 0
36 37 1 0 0 0 0
37 38 1 0 0 0 0
38 39 1 0 0 0 0
39 40 1 1 0 0 0
40 35 1 1 0 0 0
39 41 1 0 0 0 0
38 42 1 0 0 0 0
40 43 1 0 0 0 0
35 44 1 0 0 0 0
36 20 1 0 0 0 0
30 32 1 0 0 0 0
16 45 1 0 0 0 0
S SKP 5
ID FL5FACGS0057
FORMULA C29H32O16
EXACTMASS 636.1690349759999
AVERAGEMASS 636.5547799999999
SMILES OC(C1Oc(c2)cc(O4)c(C(C(=C(c(c5)ccc(c5O)O)4)OC(O3)C(C(O)C(OC(C)=O)C3C)O)=O)c2O)C(C(C(O1)C)O)O
M END
