Mol:LBF09000HO05
From Metabolomics.JP
(Difference between revisions)
| Line 1: | Line 1: | ||
| − | + | ||
| − | + | ||
| − | 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 |
| − | 1.1419 -0.0921 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.1419 -0.0921 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.7249 -0.6751 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.7249 -0.6751 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.3519 -0.0921 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.3519 -0.0921 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.9391 -0.5912 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.9391 -0.5912 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.3574 0.6751 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.3574 0.6751 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.5589 -0.6751 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.5589 -0.6751 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.0241 -0.0921 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.0241 -0.0921 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.6071 -0.6751 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.6071 -0.6751 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.1901 -0.0921 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.1901 -0.0921 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.7731 -0.6751 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.7731 -0.6751 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.3561 -0.0921 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.3561 -0.0921 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.9391 -0.6751 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.9391 -0.6751 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 |
| − | S SKP 5 | + | S SKP 5 |
| − | ID LBF09000HO05 | + | ID LBF09000HO05 |
| − | FORMULA C9H18O3 | + | FORMULA C9H18O3 |
| − | EXACTMASS 174.125594442 | + | EXACTMASS 174.125594442 |
| − | AVERAGEMASS 174.23742 | + | AVERAGEMASS 174.23742 |
| − | SMILES OCCCCCCCCC(O)=O | + | SMILES OCCCCCCCCC(O)=O |
M END | M END | ||
| − | |||
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
1.1419 -0.0921 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7249 -0.6751 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3519 -0.0921 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.9391 -0.5912 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.3574 0.6751 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.5589 -0.6751 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0241 -0.0921 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6071 -0.6751 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1901 -0.0921 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7731 -0.6751 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3561 -0.0921 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.9391 -0.6751 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
S SKP 5
ID LBF09000HO05
FORMULA C9H18O3
EXACTMASS 174.125594442
AVERAGEMASS 174.23742
SMILES OCCCCCCCCC(O)=O
M END
