Mol:FL5FACGA0040
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/
46 50 0 0 0 0 0 0 0 0999 V2000
-2.4098 0.0792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4098 -0.7459 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6953 -1.1583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.9808 -0.7459 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.9808 0.0792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6953 0.4918 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2662 -1.1583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4483 -0.7459 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4483 0.0792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2662 0.4918 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.2662 -1.8017 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.3480 0.6505 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0763 0.2301 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8044 0.6505 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8044 1.4914 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0763 1.9118 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3480 1.4914 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6953 -1.9831 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.5839 1.9414 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.0720 0.6621 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.2567 -1.2125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-4.5401 0.8787 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.8655 0.4892 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.0795 1.2382 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.8655 1.9917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.5401 2.3813 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.3261 1.6322 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.1097 2.8116 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.8655 2.4777 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.9328 1.7948 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-5.1704 0.8483 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.0763 2.7525 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.2626 -0.6239 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8762 -1.2930 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6191 -1.0807 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.3666 -1.2930 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7531 -0.6239 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.0101 -0.8360 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4858 -0.7570 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.2729 -0.4397 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.6926 0.0250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.1177 -1.1913 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5771 -1.6775 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.5784 -2.4237 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.8964 -2.7675 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
5.1704 -2.8116 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
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
26 28 1 0 0 0 0
25 29 1 0 0 0 0
27 30 1 0 0 0 0
22 31 1 0 0 0 0
23 20 1 0 0 0 0
16 32 1 0 0 0 0
33 34 1 0 0 0 0
34 35 1 1 0 0 0
35 36 1 1 0 0 0
37 36 1 1 0 0 0
37 38 1 0 0 0 0
38 33 1 0 0 0 0
33 39 1 0 0 0 0
38 40 1 0 0 0 0
37 41 1 0 0 0 0
36 42 1 0 0 0 0
34 21 1 0 0 0 0
42 43 1 0 0 0 0
43 44 1 0 0 0 0
44 45 2 0 0 0 0
44 46 1 0 0 0 0
S SKP 5
ID FL5FACGA0040
FORMULA C29H32O17
EXACTMASS 652.163949598
AVERAGEMASS 652.55418
SMILES OC(C1Oc(c5)cc(O3)c(c5O)C(=O)C(=C(c(c4)ccc(c4O)O)3)OC(C(O)2)OC(C(O)C(O)2)COC(C)=O)C(C(C(O1)C)O)O
M END
