Mol:LBF08000BC03
From Metabolomics.JP
(Difference between revisions)
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| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 11 10 0 0 1 0 0 0 0 0999 V2000 | + | 11 10 0 0 1 0 0 0 0 0999 V2000 |
| − | 0.4601 0.3572 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 | + | 0.4601 0.3572 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 |
| − | 0.4601 -0.4022 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.4601 -0.4022 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.7688 0.3572 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.7688 0.3572 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.2356 -1.0716 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.2356 -1.0716 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.4106 -1.0716 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.4106 -1.0716 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.0018 -0.3572 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.0018 -0.3572 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.8268 -0.3572 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.8268 -0.3572 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.2393 0.3572 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.2393 0.3572 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.3564 0.3572 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.3564 0.3572 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.7688 1.0716 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.7688 1.0716 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.7688 -0.3572 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.7688 -0.3572 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1 2 1 4 0 0 0 | + | 1 2 1 4 0 0 0 |
| − | 1 4 1 0 0 0 0 | + | 1 4 1 0 0 0 0 |
| − | 3 8 1 0 0 0 0 | + | 3 8 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 |
| − | 1 9 1 0 0 0 0 | + | 1 9 1 0 0 0 0 |
| − | 9 10 2 0 0 0 0 | + | 9 10 2 0 0 0 0 |
| − | 9 11 1 0 0 0 0 | + | 9 11 1 0 0 0 0 |
| − | S SKP 5 | + | S SKP 5 |
| − | ID LBF08000BC03 | + | ID LBF08000BC03 |
| − | FORMULA C9H18O2 | + | FORMULA C9H18O2 |
| − | EXACTMASS 158.13067981999998 | + | EXACTMASS 158.13067981999998 |
| − | AVERAGEMASS 158.23802 | + | AVERAGEMASS 158.23802 |
| − | SMILES CCCCCCC(C)C(O)=O | + | SMILES CCCCCCC(C)C(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/
11 10 0 0 1 0 0 0 0 0999 V2000
0.4601 0.3572 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0
0.4601 -0.4022 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7688 0.3572 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2356 -1.0716 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4106 -1.0716 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0018 -0.3572 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8268 -0.3572 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.2393 0.3572 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3564 0.3572 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7688 1.0716 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.7688 -0.3572 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1 2 1 4 0 0 0
1 4 1 0 0 0 0
3 8 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
1 9 1 0 0 0 0
9 10 2 0 0 0 0
9 11 1 0 0 0 0
S SKP 5
ID LBF08000BC03
FORMULA C9H18O2
EXACTMASS 158.13067981999998
AVERAGEMASS 158.23802
SMILES CCCCCCC(C)C(O)=O
M END
