Mol:LBF15000BC02
From Metabolomics.JP
(Difference between revisions)
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| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 19 18 0 0 1 0 0 0 0 0999 V2000 | + | 19 18 0 0 1 0 0 0 0 0999 V2000 |
| − | -2.6915 2.1421 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.6915 2.1421 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.7528 2.1421 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 | + | -0.7528 2.1421 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 |
| − | -0.7528 1.4518 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.7528 1.4518 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.4554 2.1421 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 | + | 1.4554 2.1421 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 |
| − | 1.4554 1.4518 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.4554 1.4518 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.2790 2.1434 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.2790 2.1434 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.6915 2.8579 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.6915 2.8579 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.6915 1.4289 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.6915 1.4289 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.0722 2.1434 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.0722 2.1434 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.4847 1.4289 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.4847 1.4289 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.3097 1.4289 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.3097 1.4289 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.4252 2.1434 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.4252 2.1434 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.0127 1.4289 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.0127 1.4289 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.4252 0.7145 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.4252 0.7145 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.0127 -0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.0127 -0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.4252 -0.7145 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.4252 -0.7145 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.0127 -1.4289 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.0127 -1.4289 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.4252 -2.1434 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.4252 -2.1434 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.0127 -2.8579 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.0127 -2.8579 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2 3 1 4 0 0 0 | + | 2 3 1 4 0 0 0 |
| − | 4 5 1 4 0 0 0 | + | 4 5 1 4 0 0 0 |
| − | 4 6 1 0 0 0 0 | + | 4 6 1 0 0 0 0 |
| − | 6 7 2 0 0 0 0 | + | 6 7 2 0 0 0 0 |
| − | 6 8 1 0 0 0 0 | + | 6 8 1 0 0 0 0 |
| − | 2 9 1 0 0 0 0 | + | 2 9 1 0 0 0 0 |
| − | 4 11 1 0 0 0 0 | + | 4 11 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 |
| − | 1 12 1 0 0 0 0 | + | 1 12 1 0 0 0 0 |
| − | 2 19 1 0 0 0 0 | + | 2 19 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 |
| − | 15 16 1 0 0 0 0 | + | 15 16 1 0 0 0 0 |
| − | 16 17 1 0 0 0 0 | + | 16 17 1 0 0 0 0 |
| − | 17 18 1 0 0 0 0 | + | 17 18 1 0 0 0 0 |
| − | 18 19 1 0 0 0 0 | + | 18 19 1 0 0 0 0 |
| − | S SKP 5 | + | S SKP 5 |
| − | ID LBF15000BC02 | + | ID LBF15000BC02 |
| − | FORMULA C17H34O2 | + | FORMULA C17H34O2 |
| − | EXACTMASS 270.255880332 | + | EXACTMASS 270.255880332 |
| − | AVERAGEMASS 270.45065999999997 | + | AVERAGEMASS 270.45065999999997 |
| − | SMILES CCCCCCCCCC(C)CCCC(C)C(O)=O | + | SMILES CCCCCCCCCC(C)CCCC(C)C(O)=O |
M END | M END | ||
| − | |||
Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/
19 18 0 0 1 0 0 0 0 0999 V2000
-2.6915 2.1421 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7528 2.1421 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0
-0.7528 1.4518 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4554 2.1421 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0
1.4554 1.4518 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2790 2.1434 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6915 2.8579 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.6915 1.4289 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.0722 2.1434 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4847 1.4289 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3097 1.4289 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4252 2.1434 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0127 1.4289 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4252 0.7145 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0127 -0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4252 -0.7145 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0127 -1.4289 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4252 -2.1434 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0127 -2.8579 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2 3 1 4 0 0 0
4 5 1 4 0 0 0
4 6 1 0 0 0 0
6 7 2 0 0 0 0
6 8 1 0 0 0 0
2 9 1 0 0 0 0
4 11 1 0 0 0 0
9 10 1 0 0 0 0
10 11 1 0 0 0 0
1 12 1 0 0 0 0
2 19 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
16 17 1 0 0 0 0
17 18 1 0 0 0 0
18 19 1 0 0 0 0
S SKP 5
ID LBF15000BC02
FORMULA C17H34O2
EXACTMASS 270.255880332
AVERAGEMASS 270.45065999999997
SMILES CCCCCCCCCC(C)CCCC(C)C(O)=O
M END
