Mol:FL5FAGGS0018
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/
47 51 0 0 0 0 0 0 0 0999 V2000
-1.9072 1.0540 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1737 1.4775 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1737 2.3245 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9072 2.7481 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.6408 2.3245 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.6408 1.4775 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4401 1.0540 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2934 1.4775 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2934 2.3245 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4401 2.7481 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.1149 2.7989 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8455 2.3770 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5761 2.7989 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5761 3.6424 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8455 4.0643 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.1149 3.6424 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8455 4.7773 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.2906 4.0549 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.2383 2.4166 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.9420 1.1031 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.2906 2.6998 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.9072 0.4491 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.4401 0.3972 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.5275 0.0230 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.9705 -0.7443 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1185 -0.5008 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7385 -0.7254 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.1816 0.0418 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3296 -0.2016 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.2699 -0.1224 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6922 -0.4641 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.3912 -0.7891 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3899 -1.4935 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.9429 -0.4712 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5747 -1.2095 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.7311 -1.5312 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.4555 -1.9588 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0037 -1.4321 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.4521 -2.5749 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7516 -2.9794 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7516 -3.7884 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4521 -4.1928 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1527 -3.7883 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1527 -2.9794 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4522 -4.7773 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.7634 -4.1409 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.2116 -4.1001 0.0000 O 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 2 0 0 0 0
9 10 1 0 0 0 0
10 3 1 0 0 0 0
9 11 1 0 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
15 17 1 0 0 0 0
14 18 1 0 0 0 0
13 19 1 0 0 0 0
8 20 1 0 0 0 0
5 21 1 0 0 0 0
1 22 1 0 0 0 0
7 23 2 0 0 0 0
24 25 1 0 0 0 0
25 26 1 1 0 0 0
27 26 1 1 0 0 0
28 27 1 1 0 0 0
28 29 1 0 0 0 0
29 24 1 0 0 0 0
20 28 1 0 0 0 0
24 30 1 0 0 0 0
25 31 1 0 0 0 0
31 32 1 0 0 0 0
32 33 2 0 0 0 0
32 34 1 0 0 0 0
26 35 1 0 0 0 0
27 36 1 0 0 0 0
36 37 1 0 0 0 0
37 38 2 0 0 0 0
37 39 1 0 0 0 0
39 40 2 0 0 0 0
40 41 1 0 0 0 0
41 42 2 0 0 0 0
42 43 1 0 0 0 0
43 44 2 0 0 0 0
44 39 1 0 0 0 0
42 45 1 0 0 0 0
43 46 1 0 0 0 0
41 47 1 0 0 0 0
S SKP 5
ID FL5FAGGS0018
FORMULA C30H26O17
EXACTMASS 658.116999406
AVERAGEMASS 658.51724
SMILES c(c31)c(cc(O)c(C(=O)C(OC(O4)C(OC(=O)c(c5)cc(O)c(c(O)5)O)C(C(C4C)OC(C)=O)O)=C(O3)c(c2)cc(c(c(O)2)O)O)1)O
M END
