Mol:LBF18205SC01
From Metabolomics.JP
(Difference between revisions)
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| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 20 19 0 0 0 0 0 0 0 0999 V2000 | + | 20 19 0 0 0 0 0 0 0 0999 V2000 |
| − | 3.4265 -0.6566 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.4265 -0.6566 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.9985 0.0309 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.9985 0.0309 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.6035 -0.6098 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.6035 -0.6098 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.9985 0.7116 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.9985 0.7116 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.8765 0.0859 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.8765 0.0859 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.3265 -0.6566 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.3265 -0.6566 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.8315 0.0859 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.8315 0.0859 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.3640 -0.7116 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.3640 -0.7116 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.8690 0.0859 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.8690 0.0859 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.3465 -0.7116 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.3465 -0.7116 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.1760 0.0309 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.1760 0.0309 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.5885 -0.7116 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.5885 -0.7116 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.1935 -0.7116 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.1935 -0.7116 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.6060 0.0309 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.6060 0.0309 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.0185 -0.7116 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.0185 -0.7116 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.7885 -0.7116 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.7885 -0.7116 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.2835 0.0859 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.2835 0.0859 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.6960 -0.7116 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.6960 -0.7116 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -4.1635 0.0859 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -4.1635 0.0859 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -4.6035 -0.7116 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -4.6035 -0.7116 0.0000 C 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 |
| − | 2 4 2 0 0 0 0 | + | 2 4 2 0 0 0 0 |
| − | 1 5 1 0 0 0 0 | + | 1 5 1 0 0 0 0 |
| − | 5 6 1 0 0 0 0 | + | 5 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 2 0 0 0 0 | + | 12 13 2 0 0 0 0 |
| − | 13 14 1 0 0 0 0 | + | 13 14 1 0 0 0 0 |
| − | 15 14 1 0 0 0 0 | + | 15 14 1 0 0 0 0 |
| − | 15 16 2 0 0 0 0 | + | 15 16 2 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 |
| − | 19 20 1 0 0 0 0 | + | 19 20 1 0 0 0 0 |
| − | S SKP 5 | + | S SKP 5 |
| − | ID LBF18205SC01 | + | ID LBF18205SC01 |
| − | FORMULA C18H32O2 | + | FORMULA C18H32O2 |
| − | EXACTMASS 280.240230268 | + | EXACTMASS 280.240230268 |
| − | AVERAGEMASS 280.44548000000003 | + | AVERAGEMASS 280.44548000000003 |
| − | SMILES CCCCC=CCC=CCCCCCCCCC(O)=O | + | SMILES CCCCC=CCC=CCCCCCCCCC(O)=O |
M END | M END | ||
| − | |||
Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/
20 19 0 0 0 0 0 0 0 0999 V2000
3.4265 -0.6566 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.9985 0.0309 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.6035 -0.6098 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.9985 0.7116 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.8765 0.0859 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3265 -0.6566 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8315 0.0859 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3640 -0.7116 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8690 0.0859 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3465 -0.7116 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1760 0.0309 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5885 -0.7116 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1935 -0.7116 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6060 0.0309 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0185 -0.7116 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.7885 -0.7116 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.2835 0.0859 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.6960 -0.7116 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.1635 0.0859 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.6035 -0.7116 0.0000 C 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
2 4 2 0 0 0 0
1 5 1 0 0 0 0
5 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 2 0 0 0 0
13 14 1 0 0 0 0
15 14 1 0 0 0 0
15 16 2 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
19 20 1 0 0 0 0
S SKP 5
ID LBF18205SC01
FORMULA C18H32O2
EXACTMASS 280.240230268
AVERAGEMASS 280.44548000000003
SMILES CCCCC=CCC=CCCCCCCCCC(O)=O
M END
