Mol:LBF13000HO02
From Metabolomics.JP
(Difference between revisions)
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| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 16 15 0 0 1 0 0 0 0 0999 V2000 | + | 16 15 0 0 1 0 0 0 0 0999 V2000 |
| − | 2.1131 0.3204 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.1131 0.3204 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.6960 -0.2626 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.6960 -0.2626 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.3231 0.3204 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.3231 0.3204 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.9102 -0.1787 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.9102 -0.1787 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.3285 1.0876 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.3285 1.0876 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.5301 -0.2626 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 | + | 1.5301 -0.2626 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 |
| − | 0.9471 0.3204 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.9471 0.3204 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.3640 -0.2626 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.3640 -0.2626 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.2190 0.3204 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.2190 0.3204 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.8019 -0.2626 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.8019 -0.2626 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.3849 0.3204 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.3849 0.3204 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.9679 -0.2626 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.9679 -0.2626 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.5785 0.4029 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.5785 0.4029 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.3269 -0.3730 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.3269 -0.3730 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.9102 0.2104 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.9102 0.2104 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.5301 -1.0876 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.5301 -1.0876 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1 2 1 0 0 0 0 | + | 1 2 1 0 0 0 0 |
| − | 2 3 1 0 0 0 0 | + | 2 3 1 0 0 0 0 |
| − | 3 4 1 0 0 0 0 | + | 3 4 1 0 0 0 0 |
| − | 3 5 2 0 0 0 0 | + | 3 5 2 0 0 0 0 |
| − | 1 6 1 0 0 0 0 | + | 1 6 1 0 0 0 0 |
| − | 6 7 1 0 0 0 0 | + | 6 7 1 0 0 0 0 |
| − | 7 8 1 0 0 0 0 | + | 7 8 1 0 0 0 0 |
| − | 8 9 1 0 0 0 0 | + | 8 9 1 0 0 0 0 |
| − | 9 10 1 0 0 0 0 | + | 9 10 1 0 0 0 0 |
| − | 10 11 1 0 0 0 0 | + | 10 11 1 0 0 0 0 |
| − | 11 12 1 0 0 0 0 | + | 11 12 1 0 0 0 0 |
| − | 12 13 1 0 0 0 0 | + | 12 13 1 0 0 0 0 |
| − | 13 14 1 0 0 0 0 | + | 13 14 1 0 0 0 0 |
| − | 14 15 1 0 0 0 0 | + | 14 15 1 0 0 0 0 |
| − | 6 16 1 4 0 0 0 | + | 6 16 1 4 0 0 0 |
| − | S SKP 5 | + | S SKP 5 |
| − | ID LBF13000HO02 | + | ID LBF13000HO02 |
| − | FORMULA C13H26O3 | + | FORMULA C13H26O3 |
| − | EXACTMASS 230.188194698 | + | EXACTMASS 230.188194698 |
| − | AVERAGEMASS 230.34373999999997 | + | AVERAGEMASS 230.34373999999997 |
| − | SMILES CCCCCCCCCC(O)CCC(O)=O | + | SMILES CCCCCCCCCC(O)CCC(O)=O |
M END | M END | ||
| − | |||
Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/
16 15 0 0 1 0 0 0 0 0999 V2000
2.1131 0.3204 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6960 -0.2626 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.3231 0.3204 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.9102 -0.1787 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.3285 1.0876 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.5301 -0.2626 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0
0.9471 0.3204 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3640 -0.2626 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2190 0.3204 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8019 -0.2626 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3849 0.3204 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9679 -0.2626 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5785 0.4029 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.3269 -0.3730 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.9102 0.2104 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.5301 -1.0876 0.0000 O 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
3 5 2 0 0 0 0
1 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
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
6 16 1 4 0 0 0
S SKP 5
ID LBF13000HO02
FORMULA C13H26O3
EXACTMASS 230.188194698
AVERAGEMASS 230.34373999999997
SMILES CCCCCCCCCC(O)CCC(O)=O
M END
