Mol:LBF18207HO03
From Metabolomics.JP
(Difference between revisions)
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| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 21 20 0 0 1 0 0 0 0 0999 V2000 | + | 21 20 0 0 1 0 0 0 0 0999 V2000 |
| − | -3.4799 0.7139 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.4799 0.7139 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.3639 0.7139 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 | + | -2.3639 0.7139 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 |
| − | -1.8881 0.7139 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.8881 0.7139 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.0485 0.7139 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.0485 0.7139 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.3639 1.1023 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.3639 1.1023 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.5520 0.7139 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.5520 0.7139 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.9642 1.4277 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.9642 1.4277 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.9642 -0.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.9642 -0.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.1744 0.7139 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.1744 0.7139 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.7622 -0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.7622 -0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.9379 -0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.9379 -0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.5258 -0.7139 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.5258 -0.7139 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.4799 -1.4277 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.4799 -1.4277 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.6556 -1.4277 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.6556 -1.4277 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.2435 -0.7139 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.2435 -0.7139 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.4192 -0.7139 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.4192 -0.7139 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.0071 -0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.0071 -0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.1828 -0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.1828 -0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.2294 0.7139 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.2294 0.7139 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.8881 0.7139 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.8881 0.7139 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.0485 0.7139 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.0485 0.7139 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2 20 1 0 0 0 0 | + | 2 20 1 0 0 0 0 |
| − | 3 21 1 0 0 0 0 | + | 3 21 1 0 0 0 0 |
| − | 2 5 1 4 0 0 0 | + | 2 5 1 4 0 0 0 |
| − | 6 7 2 0 0 0 0 | + | 6 7 2 0 0 0 0 |
| − | 6 8 1 0 0 0 0 | + | 6 8 1 0 0 0 0 |
| − | 1 9 1 0 0 0 0 | + | 1 9 1 0 0 0 0 |
| − | 2 12 1 0 0 0 0 | + | 2 12 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 |
| − | 6 13 1 0 0 0 0 | + | 6 13 1 0 0 0 0 |
| − | 4 19 1 0 0 0 0 | + | 4 19 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 |
| − | 17 18 1 0 0 0 0 | + | 17 18 1 0 0 0 0 |
| − | 18 19 1 0 0 0 0 | + | 18 19 1 0 0 0 0 |
| − | 3 20 2 0 0 0 0 | + | 3 20 2 0 0 0 0 |
| − | 4 21 2 0 0 0 0 | + | 4 21 2 0 0 0 0 |
| − | S SKP 5 | + | S SKP 5 |
| − | ID LBF18207HO03 | + | ID LBF18207HO03 |
| − | FORMULA C18H32O3 | + | FORMULA C18H32O3 |
| − | EXACTMASS 296.23514489 | + | EXACTMASS 296.23514489 |
| − | AVERAGEMASS 296.44488 | + | AVERAGEMASS 296.44488 |
| − | SMILES CCCCCC(O)C=CC=CCCCCCCCC(O)=O | + | SMILES CCCCCC(O)C=CC=CCCCCCCCC(O)=O |
M END | M END | ||
| − | |||
Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/
21 20 0 0 1 0 0 0 0 0999 V2000
-3.4799 0.7139 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3639 0.7139 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0
-1.8881 0.7139 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0485 0.7139 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3639 1.1023 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.5520 0.7139 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.9642 1.4277 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.9642 -0.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.1744 0.7139 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.7622 -0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9379 -0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5258 -0.7139 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.4799 -1.4277 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6556 -1.4277 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2435 -0.7139 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4192 -0.7139 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0071 -0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1828 -0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2294 0.7139 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8881 0.7139 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0485 0.7139 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2 20 1 0 0 0 0
3 21 1 0 0 0 0
2 5 1 4 0 0 0
6 7 2 0 0 0 0
6 8 1 0 0 0 0
1 9 1 0 0 0 0
2 12 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
6 13 1 0 0 0 0
4 19 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
17 18 1 0 0 0 0
18 19 1 0 0 0 0
3 20 2 0 0 0 0
4 21 2 0 0 0 0
S SKP 5
ID LBF18207HO03
FORMULA C18H32O3
EXACTMASS 296.23514489
AVERAGEMASS 296.44488
SMILES CCCCCC(O)C=CC=CCCCCCCCC(O)=O
M END
