Mol:LBF10000SC01
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 |
| − | 2.6187 -0.1691 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.6187 -0.1691 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.3337 -0.5802 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.3337 -0.5802 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.6187 0.6586 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.6187 0.6586 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.0054 -0.6270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.0054 -0.6270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.3179 -0.1320 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.3179 -0.1320 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.6566 -0.6256 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.6566 -0.6256 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.0117 -0.1444 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.0117 -0.1444 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.6717 -0.6366 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.6717 -0.6366 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.3427 -0.1540 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.3427 -0.1540 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.0054 -0.6476 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.0054 -0.6476 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.6737 -0.1664 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.6737 -0.1664 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.3337 -0.6586 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.3337 -0.6586 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 |
| − | 1 3 2 0 0 0 0 | + | 1 3 2 0 0 0 0 |
| − | 4 1 1 0 0 0 0 | + | 4 1 1 0 0 0 0 |
| − | 4 5 1 0 0 0 0 | + | 4 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 |
| − | S SKP 5 | + | S SKP 5 |
| − | ID LBF10000SC01 | + | ID LBF10000SC01 |
| − | FORMULA C10H20O2 | + | FORMULA C10H20O2 |
| − | EXACTMASS 172.14632988399998 | + | EXACTMASS 172.14632988399998 |
| − | AVERAGEMASS 172.2646 | + | AVERAGEMASS 172.2646 |
| − | SMILES CCCCCCCCCC(O)=O | + | SMILES CCCCCCCCCC(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
2.6187 -0.1691 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.3337 -0.5802 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.6187 0.6586 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.0054 -0.6270 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3179 -0.1320 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6566 -0.6256 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0117 -0.1444 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6717 -0.6366 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3427 -0.1540 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0054 -0.6476 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.6737 -0.1664 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.3337 -0.6586 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1 2 1 0 0 0 0
1 3 2 0 0 0 0
4 1 1 0 0 0 0
4 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
S SKP 5
ID LBF10000SC01
FORMULA C10H20O2
EXACTMASS 172.14632988399998
AVERAGEMASS 172.2646
SMILES CCCCCCCCCC(O)=O
M END
