Mol:LBF18106HO01
From Metabolomics.JP
<pre>
Copyright: ARM project http://www.metabolome.jp/
21 20 0 0 1 0 0 0 0 0999 V2000
-0.6592 -0.6188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0553 -0.2062 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0
0.7697 -0.6188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4842 -0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1987 -0.6188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.9131 -0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.6276 -0.6188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.3421 -0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.0566 -0.6188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.7710 -0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.4855 -0.6188 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
5.7710 0.6188 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.3737 -0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0881 -0.6188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.9131 -0.6188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.6276 -0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.3421 -0.6188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.0566 -0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.7710 -0.6188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0553 0.6188 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-6.4855 -0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1 2 1 0 0 0 0
2 3 1 0 0 0 0
3 4 1 0 0 0 0
4 5 1 0 0 0 0
5 6 1 0 0 0 0
6 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 11 1 0 0 0 0
10 12 2 0 0 0 0
1 13 1 0 0 0 0
13 14 1 0 0 0 0
14 15 2 0 0 0 0
15 16 1 0 0 0 0
16 17 1 0 0 0 0
17 18 1 0 0 0 0
18 19 1 0 0 0 0
2 20 1 4 0 0 0
19 21 1 0 0 0 0
S SKP 5
ID LBF18106HO01
FORMULA C18H34O3
EXACTMASS 298.25079495399996
AVERAGEMASS 298.46076
SMILES CCCCCC=CCCC(O)CCCCCCCC(O)=O
M END
</pre>
