Mol:FL5FADGS0025
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/
53 58 0 0 0 0 0 0 0 0999 V2000
3.0234 1.3277 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3091 1.7401 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3091 2.5651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.0234 2.9776 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7379 2.5651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7379 1.7401 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.5946 1.3277 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8801 1.7401 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.1656 1.3277 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1656 0.5027 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8801 0.0902 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.5946 0.5027 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5488 1.7401 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.2632 1.3277 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.2632 0.5027 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5488 0.0902 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8801 -0.7348 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.9777 1.7401 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.3091 0.0902 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.5488 -0.7348 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.4524 2.9776 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.0234 3.8026 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.7477 4.2207 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4166 -3.5072 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2332 -3.6263 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.5639 -2.8702 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2336 -2.3881 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4171 -2.2689 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.0863 -3.0250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5200 -2.7776 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.7233 -4.1040 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.1244 -4.2207 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.3564 -2.0239 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.1796 -2.0834 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4544 -1.3052 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0874 -0.7758 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2643 -0.7162 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.9894 -1.4944 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3765 -1.5031 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1427 -1.9924 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.0897 -2.6309 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.6735 -2.5376 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.3636 -1.2301 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.5228 1.0142 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.9355 0.2996 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.1420 0.5263 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3437 0.3171 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9310 1.0317 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.7246 0.8050 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.3483 -0.3602 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.6994 -0.1181 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-4.4524 0.4292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-4.2161 0.8901 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
16 20 1 0 0 0 0
5 21 1 0 0 0 0
4 22 1 0 0 0 0
22 23 1 0 0 0 0
24 25 1 1 0 0 0
25 26 1 1 0 0 0
27 26 1 1 0 0 0
27 28 1 0 0 0 0
28 29 1 0 0 0 0
29 24 1 0 0 0 0
26 30 1 0 0 0 0
25 31 1 0 0 0 0
24 32 1 0 0 0 0
33 34 1 1 0 0 0
34 35 1 1 0 0 0
36 35 1 1 0 0 0
36 37 1 0 0 0 0
37 38 1 0 0 0 0
38 33 1 0 0 0 0
38 39 1 0 0 0 0
39 40 1 0 0 0 0
33 41 1 0 0 0 0
34 42 1 0 0 0 0
35 43 1 0 0 0 0
44 45 1 0 0 0 0
45 46 1 1 0 0 0
47 46 1 1 0 0 0
48 47 1 1 0 0 0
48 49 1 0 0 0 0
49 44 1 0 0 0 0
47 50 1 0 0 0 0
46 51 1 0 0 0 0
45 52 1 0 0 0 0
44 53 1 0 0 0 0
48 18 1 0 0 0 0
36 19 1 0 0 0 0
27 43 1 0 0 0 0
S SKP 5
ID FL5FADGS0025
FORMULA C33H40O20
EXACTMASS 756.21129372
AVERAGEMASS 756.6587
SMILES O(C(O6)C(C(O)C(O)C6)O)C(C1OC(C4=O)=C(c(c5)cc(OC)c(O)c5)Oc(c42)cc(OC(O3)C(O)C(O)C(C3C)O)cc2O)C(C(O)C(O1)CO)O
M END
