Mol:LBF17307HO01
From Metabolomics.JP
<pre>
Copyright: ARM project http://www.metabolome.jp/
20 19 0 0 1 0 0 0 0 0999 V2000
-3.5296 0.4125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.1171 -0.3025 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.2921 -0.3025 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.2921 1.1261 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.1171 1.1261 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5785 0.7150 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8649 1.1261 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1512 0.7150 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5771 -0.7150 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7521 -0.7150 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0385 -1.1261 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0
0.6751 -0.7150 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3888 -1.1261 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1024 -0.7150 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8160 -1.1261 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.5296 -0.7150 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0385 -1.9511 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.5624 1.1261 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5624 1.9511 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.2769 0.7136 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1 2 1 0 0 0 0
2 3 2 0 0 0 0
4 5 2 0 0 0 0
1 5 1 0 0 0 0
4 6 1 0 0 0 0
6 7 1 0 0 0 0
7 8 1 0 0 0 0
3 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 13 1 0 0 0 0
13 14 1 0 0 0 0
14 15 1 0 0 0 0
15 16 1 0 0 0 0
11 17 1 6 0 0 0
8 18 1 0 0 0 0
18 19 2 0 0 0 0
18 20 1 0 0 0 0
S SKP 5
ID LBF17307HO01
FORMULA C17H28O3
EXACTMASS 280.203844762
AVERAGEMASS 280.40242
SMILES CCCCCC(O)C=CC=CCC=CCCCC(O)=O
M END
</pre>
