Mol:FL2FACNI0024
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/
36 38 0 0 0 0 0 0 0 0999 V2000
-1.4179 -1.0421 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7142 -1.4484 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0102 -1.0421 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0102 -0.2292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7142 0.1773 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4179 -0.2292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6938 -1.4484 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3978 -1.0421 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3978 -0.2292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6938 0.1773 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.1011 0.1769 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6952 -2.1991 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.8230 -0.2400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.5453 0.1769 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.5453 1.0108 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8230 1.4276 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1011 1.0108 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7128 -2.1999 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.2664 1.4269 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.8215 2.1319 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.1617 0.1827 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.4271 1.4202 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7077 1.0049 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0100 1.4193 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7262 1.0059 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0100 2.2462 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4423 1.4193 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1568 1.0068 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.8713 1.4193 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.5858 1.0068 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.8713 2.2443 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1229 -1.4212 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.8374 -1.0087 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.5519 -1.4212 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.2664 -1.0087 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.5519 -2.2462 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1 2 2 0
2 3 1 0
3 4 2 0
4 5 1 0
5 6 2 0
6 1 1 0
3 7 1 0
7 8 1 0
8 9 1 0
9 10 1 0
10 4 1 0
9 11 1 0
7 12 2 0
11 13 2 0
13 14 1 0
14 15 2 0
15 16 1 0
16 17 2 0
17 11 1 0
2 18 1 0
15 19 1 0
16 20 1 0
21 6 1 0
22 23 1 0
23 24 2 0
24 25 1 0
24 26 1 0
25 27 1 0
27 28 1 0
28 29 2 0
29 30 1 0
29 31 1 0
17 22 1 0
32 33 1 0
33 34 2 0
34 35 1 0
34 36 1 0
1 32 1 0
S SKP 5
ID FL2FACNI0024
FORMULA C30H36O6
EXACTMASS 492.251188884
AVERAGEMASS 492.60324
SMILES Oc(c3O)ccc(c3CC=C(CCC=C(C)C)C)C(O1)CC(c(c2O)c(cc(c2CC=C(C)C)O)1)=O
M END
