Mol:LBF09000OX02
From Metabolomics.JP
(Difference between revisions)
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| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 12 11 0 0 0 0 0 0 0 0999 V2000 | + | 12 11 0 0 0 0 0 0 0 0999 V2000 |
| − | 0.3572 -0.2063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.3572 -0.2063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.0717 0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.0717 0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.7862 -0.2063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.7862 -0.2063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.5006 0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.5006 0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.2151 -0.2063 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.2151 -0.2063 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.5006 1.0312 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.5006 1.0312 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.3572 0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.3572 0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.0717 -0.2063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.0717 -0.2063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.7862 0.2063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.7862 0.2063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.5006 -0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.5006 -0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.2151 0.2063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.2151 0.2063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.3572 -1.0312 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.3572 -1.0312 0.0000 O 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 |
| − | 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 |
| − | 4 6 2 0 0 0 0 | + | 4 6 2 0 0 0 0 |
| − | 1 7 1 0 0 0 0 | + | 1 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 |
| − | 1 12 2 0 0 0 0 | + | 1 12 2 0 0 0 0 |
| − | S SKP 5 | + | S SKP 5 |
| − | ID LBF09000OX02 | + | ID LBF09000OX02 |
| − | FORMULA C9H16O3 | + | FORMULA C9H16O3 |
| − | EXACTMASS 172.109944378 | + | EXACTMASS 172.109944378 |
| − | AVERAGEMASS 172.22154 | + | AVERAGEMASS 172.22154 |
| − | SMILES CCCCCC(=O)CCC(O)=O | + | SMILES CCCCCC(=O)CCC(O)=O |
M END | M END | ||
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Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/
12 11 0 0 0 0 0 0 0 0999 V2000
0.3572 -0.2063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0717 0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7862 -0.2063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5006 0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2151 -0.2063 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.5006 1.0312 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.3572 0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0717 -0.2063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7862 0.2063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5006 -0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.2151 0.2063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3572 -1.0312 0.0000 O 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
3 4 1 0 0 0 0
4 5 1 0 0 0 0
4 6 2 0 0 0 0
1 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
1 12 2 0 0 0 0
S SKP 5
ID LBF09000OX02
FORMULA C9H16O3
EXACTMASS 172.109944378
AVERAGEMASS 172.22154
SMILES CCCCCC(=O)CCC(O)=O
M END
