Mol:FL3FCKGS0003
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/
45 49 0 0 0 0 0 0 0 0999 V2000
1.8699 2.4920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8699 1.6670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5844 1.2545 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2988 1.6670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2988 2.4920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5844 2.9045 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.1554 1.2545 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4410 1.6670 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.2735 1.2545 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2735 0.4295 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4410 0.0170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.1554 0.4295 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.9880 1.6670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7025 1.2545 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7025 0.4295 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.9880 0.0170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4410 -0.7013 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.4169 1.6670 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.9880 -0.6689 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.0133 2.9045 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.5844 3.7295 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.0133 1.2545 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.7278 1.6670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.7278 2.4920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.0747 1.2872 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2988 4.1420 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4822 -1.4297 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.8947 -2.1442 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1014 -1.9174 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3034 -2.1266 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8908 -1.4122 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6841 -1.6388 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.3506 -2.7818 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.6780 -2.5013 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.2620 -2.0088 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.2371 -1.4918 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.2346 -3.4557 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.5916 -3.9725 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.9232 -3.4889 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1016 -3.4133 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.7446 -2.8964 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.4131 -3.3800 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.2942 -3.7928 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-4.1938 -4.1420 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-4.7278 -3.8691 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
16 19 1 0 0 0 0
5 20 1 0 0 0 0
6 21 1 0 0 0 0
4 22 1 0 0 0 0
22 23 1 0 0 0 0
20 24 1 0 0 0 0
18 25 1 0 0 0 0
21 26 1 0 0 0 0
27 28 1 0 0 0 0
28 29 1 1 0 0 0
30 29 1 1 0 0 0
31 30 1 1 0 0 0
31 32 1 0 0 0 0
32 27 1 0 0 0 0
30 33 1 0 0 0 0
29 34 1 0 0 0 0
28 35 1 0 0 0 0
27 36 1 0 0 0 0
31 19 1 0 0 0 0
37 38 1 1 0 0 0
38 39 1 1 0 0 0
40 39 1 1 0 0 0
40 41 1 0 0 0 0
41 42 1 0 0 0 0
42 37 1 0 0 0 0
39 43 1 0 0 0 0
38 44 1 0 0 0 0
37 45 1 0 0 0 0
40 33 1 0 0 0 0
S SKP 5
ID FL3FCKGS0003
FORMULA C30H36O15
EXACTMASS 636.2054204819999
AVERAGEMASS 636.59784
SMILES O(C(OC(C(Oc(c3)c(C4=O)c(OC(c(c5)cc(OC)c(c5OC)OC)=C4)cc(OC)3)2)C(O)C(O)C(C)O2)1)CC(O)C(O)C1O
M END
