Mol:LBF14000BC09
From Metabolomics.JP
(Difference between revisions)
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| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 18 17 0 0 1 0 0 0 0 0999 V2000 | + | 18 17 0 0 1 0 0 0 0 0999 V2000 |
| − | -1.6466 2.4978 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.6466 2.4978 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.4563 2.4978 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 | + | -0.4563 2.4978 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 |
| − | 0.0835 2.4978 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.0835 2.4978 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.6946 2.4978 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 | + | 0.6946 2.4978 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 |
| − | -0.4563 2.1005 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.4563 2.1005 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.6946 2.1005 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.6946 2.1005 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.2923 2.4985 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.2923 2.4985 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.8801 1.7846 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.8801 1.7846 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.2923 1.0708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.2923 1.0708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.8801 0.3569 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.8801 0.3569 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.2923 -0.3569 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.2923 -0.3569 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.8801 -1.0708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.8801 -1.0708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.2923 -1.7846 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.2923 -1.7846 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.8801 -2.4985 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.8801 -2.4985 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.2923 -3.2123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.2923 -3.2123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.2344 2.4985 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.2344 2.4985 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.6466 3.2123 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.6466 3.2123 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.6466 1.7846 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.6466 1.7846 0.0000 O 0 0 0 0 0 0 0 0 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 |
| − | 2 5 1 4 0 0 0 | + | 2 5 1 4 0 0 0 |
| − | 4 6 1 4 0 0 0 | + | 4 6 1 4 0 0 0 |
| − | 1 7 1 0 0 0 0 | + | 1 7 1 0 0 0 0 |
| − | 2 15 1 0 0 0 0 | + | 2 15 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 |
| − | 4 16 1 0 0 0 0 | + | 4 16 1 0 0 0 0 |
| − | 16 17 2 0 0 0 0 | + | 16 17 2 0 0 0 0 |
| − | 16 18 1 0 0 0 0 | + | 16 18 1 0 0 0 0 |
| − | S SKP 5 | + | S SKP 5 |
| − | ID LBF14000BC09 | + | ID LBF14000BC09 |
| − | FORMULA C16H32O2 | + | FORMULA C16H32O2 |
| − | EXACTMASS 256.240230268 | + | EXACTMASS 256.240230268 |
| − | AVERAGEMASS 256.42408 | + | AVERAGEMASS 256.42408 |
| − | SMILES CCCCCCCCCCC(C)CC(C)C(O)=O | + | SMILES CCCCCCCCCCC(C)CC(C)C(O)=O |
M END | M END | ||
| − | |||
Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/
18 17 0 0 1 0 0 0 0 0999 V2000
-1.6466 2.4978 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4563 2.4978 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0
0.0835 2.4978 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6946 2.4978 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0
-0.4563 2.1005 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6946 2.1005 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.2923 2.4985 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8801 1.7846 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.2923 1.0708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8801 0.3569 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.2923 -0.3569 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8801 -1.0708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.2923 -1.7846 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8801 -2.4985 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.2923 -3.2123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2344 2.4985 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6466 3.2123 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.6466 1.7846 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2 3 1 0 0 0 0
3 4 1 0 0 0 0
2 5 1 4 0 0 0
4 6 1 4 0 0 0
1 7 1 0 0 0 0
2 15 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
4 16 1 0 0 0 0
16 17 2 0 0 0 0
16 18 1 0 0 0 0
S SKP 5
ID LBF14000BC09
FORMULA C16H32O2
EXACTMASS 256.240230268
AVERAGEMASS 256.42408
SMILES CCCCCCCCCCC(C)CC(C)C(O)=O
M END
