Mol:LBF08000BC01
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 |
| − | -1.3001 -0.2076 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 | + | -1.3001 -0.2076 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 |
| − | -1.8831 0.3753 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.8831 0.3753 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.4660 -0.2076 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.4660 -0.2076 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.7171 0.3753 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.7171 0.3753 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.1341 -0.2076 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.1341 -0.2076 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.4490 0.3753 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.4490 0.3753 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.0319 -0.2076 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.0319 -0.2076 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.7483 0.2049 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.7483 0.2049 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.4660 -0.2062 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.4660 -0.2062 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.7469 1.0326 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.7469 1.0326 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.3001 -1.0326 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.3001 -1.0326 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2 1 1 0 0 0 0 | + | 2 1 1 0 0 0 0 |
| − | 2 3 1 0 0 0 0 | + | 2 3 1 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 |
| − | 8 10 2 0 0 0 0 | + | 8 10 2 0 0 0 0 |
| − | 1 11 1 4 0 0 0 | + | 1 11 1 4 0 0 0 |
| − | S SKP 5 | + | S SKP 5 |
| − | ID LBF08000BC01 | + | ID LBF08000BC01 |
| − | FORMULA C9H18O2 | + | FORMULA C9H18O2 |
| − | EXACTMASS 158.13067981999998 | + | EXACTMASS 158.13067981999998 |
| − | AVERAGEMASS 158.23802 | + | AVERAGEMASS 158.23802 |
| − | SMILES CCC(C)CCCCC(O)=O | + | SMILES CCC(C)CCCCC(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
-1.3001 -0.2076 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0
-1.8831 0.3753 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4660 -0.2076 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7171 0.3753 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1341 -0.2076 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4490 0.3753 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0319 -0.2076 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7483 0.2049 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4660 -0.2062 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1.7469 1.0326 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.3001 -1.0326 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2 1 1 0 0 0 0
2 3 1 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
8 10 2 0 0 0 0
1 11 1 4 0 0 0
S SKP 5
ID LBF08000BC01
FORMULA C9H18O2
EXACTMASS 158.13067981999998
AVERAGEMASS 158.23802
SMILES CCC(C)CCCCC(O)=O
M END
