Mol:LBF20106SC01
From Metabolomics.JP
(Difference between revisions)
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| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 22 21 0 0 0 0 0 0 0 0999 V2000 | + | 22 21 0 0 0 0 0 0 0 0999 V2000 |
| − | 1.9704 0.0612 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.9704 0.0612 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.5836 0.4916 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.5836 0.4916 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.2986 0.0804 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.2986 0.0804 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.5836 1.3193 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.5836 1.3193 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.3654 0.5287 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.3654 0.5287 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.6889 0.0543 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.6889 0.0543 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.0371 0.5576 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.0371 0.5576 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.6394 0.0832 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.6394 0.0832 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.2939 0.5878 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.2939 0.5878 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.9704 0.1134 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.9704 0.1134 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.6221 0.6167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.6221 0.6167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.2986 0.1423 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.2986 0.1423 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.2986 -0.8188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.2986 -0.8188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.6221 -1.3138 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.6221 -1.3138 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.9346 -0.7638 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.9346 -0.7638 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.2677 -1.2519 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.2677 -1.2519 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.5046 -1.2519 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.5046 -1.2519 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.1279 -0.7638 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.1279 -0.7638 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.7329 -1.3138 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.7329 -1.3138 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.3654 -0.7638 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.3654 -0.7638 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.9759 -1.3193 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.9759 -1.3193 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.5987 -0.7776 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.5987 -0.7776 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 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 2 0 0 0 0 | + | 16 17 2 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 |
| − | 20 21 1 0 0 0 0 | + | 20 21 1 0 0 0 0 |
| − | 21 22 1 0 0 0 0 | + | 21 22 1 0 0 0 0 |
| − | S SKP 5 | + | S SKP 5 |
| − | ID LBF20106SC01 | + | ID LBF20106SC01 |
| − | FORMULA C20H38O2 | + | FORMULA C20H38O2 |
| − | EXACTMASS 310.28718046 | + | EXACTMASS 310.28718046 |
| − | AVERAGEMASS 310.51452 | + | AVERAGEMASS 310.51452 |
| − | SMILES C(CC=CCCCCCCCCCCCCC(O)=O)CCC | + | SMILES C(CC=CCCCCCCCCCCCCC(O)=O)CCC |
M END | M END | ||
| − | |||
Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/
22 21 0 0 0 0 0 0 0 0999 V2000
1.9704 0.0612 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5836 0.4916 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2986 0.0804 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.5836 1.3193 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.3654 0.5287 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6889 0.0543 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0371 0.5576 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6394 0.0832 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.2939 0.5878 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9704 0.1134 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.6221 0.6167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.2986 0.1423 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.2986 -0.8188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.6221 -1.3138 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9346 -0.7638 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.2677 -1.2519 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5046 -1.2519 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1279 -0.7638 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7329 -1.3138 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3654 -0.7638 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9759 -1.3193 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5987 -0.7776 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 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 2 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
20 21 1 0 0 0 0
21 22 1 0 0 0 0
S SKP 5
ID LBF20106SC01
FORMULA C20H38O2
EXACTMASS 310.28718046
AVERAGEMASS 310.51452
SMILES C(CC=CCCCCCCCCCCCCC(O)=O)CCC
M END
