Mol:LBF11000HO01
From Metabolomics.JP
(Difference between revisions)
| Line 1: | Line 1: | ||
| − | + | ||
| − | + | ||
| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 14 13 0 0 1 0 0 0 0 0999 V2000 | + | 14 13 0 0 1 0 0 0 0 0999 V2000 |
| − | 1.4334 0.3204 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.4334 0.3204 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.0164 -0.2626 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 | + | 2.0164 -0.2626 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 |
| − | 2.6434 0.3204 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.6434 0.3204 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.2306 -0.1787 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.2306 -0.1787 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.6489 1.0876 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.6489 1.0876 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.8505 -0.2626 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.8505 -0.2626 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.2675 0.3204 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.2675 0.3204 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.3156 -0.2626 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.3156 -0.2626 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.8986 0.3204 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.8986 0.3204 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.4816 -0.2626 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.4816 -0.2626 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.0645 0.3204 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.0645 0.3204 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.6475 -0.2626 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.6475 -0.2626 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.2306 0.3204 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.2306 0.3204 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.0164 -1.0876 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.0164 -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 |
| − | 2 14 1 4 0 0 0 | + | 2 14 1 4 0 0 0 |
| − | S SKP 5 | + | S SKP 5 |
| − | ID LBF11000HO01 | + | ID LBF11000HO01 |
| − | FORMULA C11H22O3 | + | FORMULA C11H22O3 |
| − | EXACTMASS 202.15689457 | + | EXACTMASS 202.15689457 |
| − | AVERAGEMASS 202.29058 | + | AVERAGEMASS 202.29058 |
| − | SMILES CCCCCCCCCC(O)C(O)=O | + | SMILES CCCCCCCCCC(O)C(O)=O |
M END | M END | ||
| − | |||
Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/
14 13 0 0 1 0 0 0 0 0999 V2000
1.4334 0.3204 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0164 -0.2626 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0
2.6434 0.3204 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2306 -0.1787 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.6489 1.0876 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.8505 -0.2626 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2675 0.3204 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3156 -0.2626 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8986 0.3204 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4816 -0.2626 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0645 0.3204 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.6475 -0.2626 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.2306 0.3204 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0164 -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
2 14 1 4 0 0 0
S SKP 5
ID LBF11000HO01
FORMULA C11H22O3
EXACTMASS 202.15689457
AVERAGEMASS 202.29058
SMILES CCCCCCCCCC(O)C(O)=O
M END
