Mol:FL5F2AGS0001
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/
32 35 0 0 0 0 0 0 0 0999 V2000
2.1631 1.3904 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1631 0.5654 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8776 0.1529 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.5921 0.5654 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.5921 1.3904 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8776 1.8029 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4487 0.1529 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7342 0.5654 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.0197 0.1529 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0197 -0.6721 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7342 -1.0846 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4487 -0.6721 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6947 0.5654 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4092 0.1529 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4092 -0.6721 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6947 -1.0846 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7342 -1.8029 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.3685 0.6039 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.0550 -1.0222 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.9550 -0.9752 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.1928 1.7372 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.8059 1.3833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.9421 -0.1511 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.3546 -0.8656 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.5614 -0.6389 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.7633 -0.8480 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3507 -0.1336 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.1441 -0.3602 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.7680 -1.5458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-4.0361 -1.1801 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-4.8059 -0.6051 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-4.5541 -0.3151 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
15 20 1 0 0 0 0
5 21 1 0 0 0 0
21 22 1 0 0 0 0
23 24 1 0 0 0 0
24 25 1 1 0 0 0
26 25 1 1 0 0 0
27 26 1 1 0 0 0
27 28 1 0 0 0 0
28 23 1 0 0 0 0
26 29 1 0 0 0 0
25 30 1 0 0 0 0
24 31 1 0 0 0 0
23 32 1 0 0 0 0
27 18 1 0 0 0 0
S SKP 5
ID FL5F2AGS0001
FORMULA C22H22O10
EXACTMASS 446.121296924
AVERAGEMASS 446.40408
SMILES O(C)c(c1)ccc(C(O2)=C(O)C(=O)c(c3)c2cc(OC(O4)C(C(C(O)C4C)O)O)c3O)c1
M END
