Mol:FL2FAAGS0028
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/
51 56 0 0 0 0 0 0 0 0999 V2000
0.0501 -0.6080 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7627 -0.1923 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0533 -1.4330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7700 -1.8423 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4827 -1.4266 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4790 -0.6016 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1990 -1.8360 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.9116 -1.4203 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.9079 -0.5953 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1917 -0.1860 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.5617 -0.2145 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.2777 -0.6242 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.9906 -0.2090 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.9874 0.6160 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.2713 1.0258 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.5585 0.6105 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2013 -2.5837 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.5754 -0.2469 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.7700 -2.5669 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
5.6061 0.9733 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.2748 0.2249 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.8622 -0.4898 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0639 -0.2806 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.2704 -0.5075 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6829 0.2073 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.4813 -0.0018 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5896 -0.8456 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.5423 -0.4079 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.8653 -0.0420 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.8007 0.4601 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.5366 0.5887 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.0918 -1.5646 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.5044 -2.2793 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.7109 -2.0525 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9126 -2.2617 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4999 -1.5471 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.2934 -1.7738 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.8966 -2.8772 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.1445 -2.6558 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.9594 -2.0878 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.7012 -1.7107 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.2935 1.9876 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.0082 2.4002 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.7814 1.6067 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.9906 0.8084 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.2760 0.3957 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.5027 1.1892 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-5.6061 0.7924 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-5.4053 2.0403 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-4.7328 2.8772 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-4.3778 2.5557 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1 2 2 0 0 0 0
1 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 2 1 0 0 0 0
5 7 1 0 0 0 0
7 8 1 0 0 0 0
8 9 1 0 0 0 0
9 10 1 0 0 0 0
10 6 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
7 17 2 0 0 0 0
1 18 1 0 0 0 0
4 19 1 0 0 0 0
14 20 1 0 0 0 0
21 22 1 1 0 0 0
22 23 1 1 0 0 0
24 23 1 1 0 0 0
24 25 1 0 0 0 0
25 26 1 0 0 0 0
26 21 1 0 0 0 0
23 27 1 0 0 0 0
22 28 1 0 0 0 0
21 29 1 0 0 0 0
26 30 1 0 0 0 0
24 18 1 0 0 0 0
31 30 1 0 0 0 0
32 33 1 0 0 0 0
33 34 1 1 0 0 0
35 34 1 1 0 0 0
36 35 1 1 0 0 0
36 37 1 0 0 0 0
37 32 1 0 0 0 0
35 38 1 0 0 0 0
34 39 1 0 0 0 0
33 40 1 0 0 0 0
32 41 1 0 0 0 0
36 27 1 0 0 0 0
42 43 1 0 0 0 0
43 44 1 1 0 0 0
45 44 1 1 0 0 0
46 45 1 1 0 0 0
46 47 1 0 0 0 0
47 42 1 0 0 0 0
45 48 1 0 0 0 0
44 49 1 0 0 0 0
43 50 1 0 0 0 0
42 51 1 0 0 0 0
46 31 1 0 0 0 0
S SKP 5
ID FL2FAAGS0028
FORMULA C33H42O18
EXACTMASS 726.23711454
AVERAGEMASS 726.67578
SMILES C(C5c(c6)ccc(O)c6)C(c(c(O)1)c(O5)cc(OC(C(OC(O4)C(O)C(C(O)C(C)4)O)3)OC(C(O)C3O)COC(O2)C(O)C(C(C(C)2)O)O)c1)=O
M END
