Mol:LBF12000BC15
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 |
| − | -3.8181 1.1679 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.8181 1.1679 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.0990 -1.7091 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.0990 -1.7091 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.0357 1.1679 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.0357 1.1679 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.4481 0.4535 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.4481 0.4535 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.2731 0.4535 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.2731 0.4535 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.6856 -0.2610 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.6856 -0.2610 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.4056 1.1679 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.4056 1.1679 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.8181 1.8824 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.8181 1.8824 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.8181 0.4535 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.8181 0.4535 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.9902 1.1679 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.9902 1.1679 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.5777 0.4535 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.5777 0.4535 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.9902 -0.2610 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.9902 -0.2610 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.5777 -0.9754 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.5777 -0.9754 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.9077 -1.8824 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.9077 -1.8824 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.3113 -0.0695 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.3113 -0.0695 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.5969 0.3430 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.5969 0.3430 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 |
| − | 3 4 1 0 0 0 0 | + | 3 4 1 0 0 0 0 |
| − | 4 5 1 0 0 0 0 | + | 4 5 1 0 0 0 0 |
| − | 6 5 1 4 0 0 0 | + | 6 5 1 4 0 0 0 |
| − | 6 7 1 0 0 0 0 | + | 6 7 1 0 0 0 0 |
| − | 7 8 2 0 0 0 0 | + | 7 8 2 0 0 0 0 |
| − | 7 9 1 0 0 0 0 | + | 7 9 1 0 0 0 0 |
| − | 1 10 1 0 0 0 0 | + | 1 10 1 0 0 0 0 |
| − | 2 14 1 0 0 0 0 | + | 2 14 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 |
| − | 2 16 1 0 0 0 0 | + | 2 16 1 0 0 0 0 |
| − | 15 16 1 0 0 0 0 | + | 15 16 1 0 0 0 0 |
| − | S SKP 5 | + | S SKP 5 |
| − | ID LBF12000BC15 | + | ID LBF12000BC15 |
| − | FORMULA C14H28O2 | + | FORMULA C14H28O2 |
| − | EXACTMASS 228.20893013999998 | + | EXACTMASS 228.20893013999998 |
| − | AVERAGEMASS 228.37091999999998 | + | AVERAGEMASS 228.37091999999998 |
| − | SMILES CCCCCCC(CC)CCCCC(O)=O | + | SMILES CCCCCCC(CC)CCCCC(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
-3.8181 1.1679 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0990 -1.7091 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0357 1.1679 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4481 0.4535 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2731 0.4535 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6856 -0.2610 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.4056 1.1679 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.8181 1.8824 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.8181 0.4535 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.9902 1.1679 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5777 0.4535 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.9902 -0.2610 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5777 -0.9754 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.9077 -1.8824 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3113 -0.0695 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5969 0.3430 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2 3 1 4 0 0 0
3 4 1 0 0 0 0
4 5 1 0 0 0 0
6 5 1 4 0 0 0
6 7 1 0 0 0 0
7 8 2 0 0 0 0
7 9 1 0 0 0 0
1 10 1 0 0 0 0
2 14 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
2 16 1 0 0 0 0
15 16 1 0 0 0 0
S SKP 5
ID LBF12000BC15
FORMULA C14H28O2
EXACTMASS 228.20893013999998
AVERAGEMASS 228.37091999999998
SMILES CCCCCCC(CC)CCCCC(O)=O
M END
