Mol:LBF18000BC10
From Metabolomics.JP
(Difference between revisions)
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| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 21 20 0 0 1 0 0 0 0 0999 V2000 | + | 21 20 0 0 1 0 0 0 0 0999 V2000 |
| − | -0.6738 4.9749 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.6738 4.9749 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.3567 2.4449 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.3567 2.4449 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.5583 4.5772 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.5583 4.5772 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.4839 5.3322 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.4839 5.3322 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.0713 4.6177 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.0713 4.6177 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.9479 4.5349 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.9479 4.5349 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.4704 4.2603 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.4704 4.2603 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.0579 3.5459 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.0579 3.5459 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.4704 2.8313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.4704 2.8313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.0579 2.1168 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.0579 2.1168 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.4704 1.4022 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.4704 1.4022 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.0579 0.6878 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.0579 0.6878 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.4704 -0.0268 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.4704 -0.0268 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.0579 -0.7413 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.0579 -0.7413 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.4704 -1.4559 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.4704 -1.4559 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.0579 -2.1703 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.0579 -2.1703 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.4704 -2.8849 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.4704 -2.8849 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.7471 -5.6894 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.7471 -5.6894 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.9442 4.9749 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.9442 4.9749 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.3567 5.6894 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.3567 5.6894 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.3567 4.2603 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.3567 4.2603 0.0000 O 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 |
| − | 1 4 1 0 0 0 0 | + | 1 4 1 0 0 0 0 |
| − | 2 5 1 0 0 0 0 | + | 2 5 1 0 0 0 0 |
| − | 4 5 1 0 0 0 0 | + | 4 5 1 0 0 0 0 |
| − | 2 6 1 0 0 0 0 | + | 2 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 |
| − | 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 |
| − | 18 17 1 4 0 0 0 | + | 18 17 1 4 0 0 0 |
| − | 18 19 1 0 0 0 0 | + | 18 19 1 0 0 0 0 |
| − | 19 20 2 0 0 0 0 | + | 19 20 2 0 0 0 0 |
| − | 19 21 1 0 0 0 0 | + | 19 21 1 0 0 0 0 |
| − | S SKP 5 | + | S SKP 5 |
| − | ID LBF18000BC10 | + | ID LBF18000BC10 |
| − | FORMULA C19H38O2 | + | FORMULA C19H38O2 |
| − | EXACTMASS 298.28718046 | + | EXACTMASS 298.28718046 |
| − | AVERAGEMASS 298.50382 | + | AVERAGEMASS 298.50382 |
| − | SMILES CCCC(C)CCCCCCCCCCCCCC(O)=O | + | SMILES CCCC(C)CCCCCCCCCCCCCC(O)=O |
M END | M END | ||
| − | |||
Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/
21 20 0 0 1 0 0 0 0 0999 V2000
-0.6738 4.9749 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3567 2.4449 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5583 4.5772 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4839 5.3322 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0713 4.6177 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.9479 4.5349 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4704 4.2603 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0579 3.5459 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4704 2.8313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0579 2.1168 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4704 1.4022 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0579 0.6878 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4704 -0.0268 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0579 -0.7413 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4704 -1.4559 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0579 -2.1703 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4704 -2.8849 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7471 -5.6894 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9442 4.9749 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3567 5.6894 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.3567 4.2603 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2 3 1 4 0 0 0
1 4 1 0 0 0 0
2 5 1 0 0 0 0
4 5 1 0 0 0 0
2 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
15 16 1 0 0 0 0
16 17 1 0 0 0 0
18 17 1 4 0 0 0
18 19 1 0 0 0 0
19 20 2 0 0 0 0
19 21 1 0 0 0 0
S SKP 5
ID LBF18000BC10
FORMULA C19H38O2
EXACTMASS 298.28718046
AVERAGEMASS 298.50382
SMILES CCCC(C)CCCCCCCCCCCCCC(O)=O
M END
