Mol:LBF15000HO01
From Metabolomics.JP
(Difference between revisions)
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| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 18 17 0 0 1 0 0 0 0 0999 V2000 | + | 18 17 0 0 1 0 0 0 0 0999 V2000 |
| − | 2.6964 0.3204 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.6964 0.3204 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.2794 -0.2626 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 | + | 3.2794 -0.2626 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 |
| − | 3.9064 0.3204 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.9064 0.3204 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.4936 -0.1787 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.4936 -0.1787 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.9119 1.0876 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.9119 1.0876 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.1134 -0.2626 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.1134 -0.2626 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.5305 0.3204 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.5305 0.3204 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.9474 -0.2626 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.9474 -0.2626 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.3644 0.3204 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.3644 0.3204 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.2186 -0.2626 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.2186 -0.2626 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.8016 0.3204 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.8016 0.3204 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.3845 -0.2626 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.3845 -0.2626 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.9951 0.4029 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.9951 0.4029 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.7435 -0.3730 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.7435 -0.3730 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.3269 0.2104 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.3269 0.2104 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.9102 -0.3730 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.9102 -0.3730 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -4.4936 0.2104 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -4.4936 0.2104 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.2794 -1.0876 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.2794 -1.0876 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 |
| − | 3 5 2 0 0 0 0 | + | 3 5 2 0 0 0 0 |
| − | 1 6 1 0 0 0 0 | + | 1 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 1 0 0 0 0 | + | 16 17 1 0 0 0 0 |
| − | 2 18 1 4 0 0 0 | + | 2 18 1 4 0 0 0 |
| − | S SKP 5 | + | S SKP 5 |
| − | ID LBF15000HO01 | + | ID LBF15000HO01 |
| − | FORMULA C15H30O3 | + | FORMULA C15H30O3 |
| − | EXACTMASS 258.21949482599996 | + | EXACTMASS 258.21949482599996 |
| − | AVERAGEMASS 258.3969 | + | AVERAGEMASS 258.3969 |
| − | SMILES CCCCCCCCCCCCCC(O)C(O)=O | + | SMILES CCCCCCCCCCCCCC(O)C(O)=O |
M END | M END | ||
| − | |||
Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/
18 17 0 0 1 0 0 0 0 0999 V2000
2.6964 0.3204 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2794 -0.2626 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0
3.9064 0.3204 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.4936 -0.1787 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.9119 1.0876 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.1134 -0.2626 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.5305 0.3204 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.9474 -0.2626 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3644 0.3204 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2186 -0.2626 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8016 0.3204 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3845 -0.2626 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9951 0.4029 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.7435 -0.3730 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.3269 0.2104 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.9102 -0.3730 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.4936 0.2104 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2794 -1.0876 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
3 5 2 0 0 0 0
1 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 1 0 0 0 0
2 18 1 4 0 0 0
S SKP 5
ID LBF15000HO01
FORMULA C15H30O3
EXACTMASS 258.21949482599996
AVERAGEMASS 258.3969
SMILES CCCCCCCCCCCCCC(O)C(O)=O
M END
