Mol:FL5FCCGS0012
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/
53 57 0 0 0 0 0 0 0 0999 V2000
2.1342 2.3049 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4197 2.7174 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4197 3.5424 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1342 3.9549 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8487 3.5424 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8487 2.7174 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7053 2.3049 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0092 2.7174 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.7237 2.3049 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7237 1.4799 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0092 1.0674 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7053 1.4799 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4381 2.7174 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1526 2.3049 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1526 1.4799 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4381 1.0674 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0092 0.2424 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.8671 2.7174 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.4197 1.0674 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.4381 0.2424 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.5632 3.9549 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.1342 4.7799 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.5632 2.3156 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4395 -0.4405 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.6078 -4.7799 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.9896 -4.0487 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5220 -3.2867 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.7804 -4.0487 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.9292 -2.6210 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4868 -1.9246 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5381 -2.0644 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.5830 -3.1241 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8686 -1.1934 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.6982 -1.1934 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.5055 -1.3601 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2823 -1.6057 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7274 -0.9107 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4644 -0.5395 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6766 -0.2938 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.2314 -0.9888 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5732 -0.4405 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5055 -0.8734 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.3531 -1.9725 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.5924 -0.9767 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.0279 -3.3426 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0279 -3.8862 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.2119 -3.9474 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.0249 -2.5236 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.5797 -2.9826 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3373 -2.9826 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2119 -3.3426 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6219 -2.7239 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.5650 -2.4405 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 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
16 20 1 0 0 0 0
5 21 1 0 0 0 0
4 22 1 0 0 0 0
18 23 1 0 0 0 0
25 26 1 0 0 0 0
26 27 1 0 0 0 0
26 28 2 0 0 0 0
27 29 1 0 0 0 0
29 30 1 0 0 0 0
29 31 1 0 0 0 0
29 32 1 0 0 0 0
33 34 2 0 0 0 0
24 33 1 0 0 0 0
30 33 1 0 0 0 0
35 36 1 1 0 0 0
36 37 1 1 0 0 0
38 37 1 1 0 0 0
38 39 1 0 0 0 0
39 40 1 0 0 0 0
40 35 1 0 0 0 0
40 41 1 0 0 0 0
35 42 1 0 0 0 0
36 43 1 0 0 0 0
37 44 1 0 0 0 0
38 19 1 0 0 0 0
51 45 1 1 0 0 0
50 45 1 1 0 0 0
49 51 1 1 0 0 0
45 46 1 0 0 0 0
51 47 1 0 0 0 0
52 49 1 0 0 0 0
48 53 1 0 0 0 0
50 52 1 0 0 0 0
45 48 1 0 0 0 0
44 49 1 0 0 0 0
24 41 1 0 0 0 0
S SKP 5
ID FL5FCCGS0012
FORMULA C33H38O20
EXACTMASS 754.1956436559999
AVERAGEMASS 754.64282
SMILES OC(C(O)1)C(OC(OC(C4=O)=C(Oc(c5)c4c(O)cc(OC)5)c(c3)cc(O)c(O)c3)C1OC(C(O)2)OCC(O)2CO)COC(=O)CC(C)(O)CC(O)=O
M END
