Mol:LBF18303SC02
From Metabolomics.JP
(Difference between revisions)
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| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 20 19 0 0 0 0 0 0 0 0999 V2000 | + | 20 19 0 0 0 0 0 0 0 0999 V2000 |
| − | 3.1102 -0.6566 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.1102 -0.6566 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.6823 0.0309 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.6823 0.0309 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.2873 -0.6098 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.2873 -0.6098 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.6823 0.7116 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.6823 0.7116 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.5602 0.0859 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.5602 0.0859 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.0102 -0.6566 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.0102 -0.6566 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.5152 0.0859 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.5152 0.0859 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.0477 -0.7116 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.0477 -0.7116 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.6077 0.0859 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.6077 0.0859 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.1402 -0.7116 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.1402 -0.7116 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.2998 0.0859 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.2998 0.0859 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.7673 -0.6566 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.7673 -0.6566 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.1798 0.0859 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.1798 0.0859 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.6748 -0.6566 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.6748 -0.6566 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.0598 0.0859 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.0598 0.0859 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.5548 -0.6291 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.5548 -0.6291 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.9948 0.0859 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.9948 0.0859 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.3798 -0.6291 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.3798 -0.6291 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.8198 0.0859 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.8198 0.0859 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -4.2873 -0.6291 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -4.2873 -0.6291 0.0000 C 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 |
| − | 2 4 2 0 0 0 0 | + | 2 4 2 0 0 0 0 |
| − | 1 5 1 0 0 0 0 | + | 1 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 |
| − | 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 2 0 0 0 0 | + | 11 12 2 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 |
| − | 15 14 2 0 0 0 0 | + | 15 14 2 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 2 0 0 0 0 | + | 17 18 2 0 0 0 0 |
| − | 18 19 1 0 0 0 0 | + | 18 19 1 0 0 0 0 |
| − | 20 19 1 0 0 0 0 | + | 20 19 1 0 0 0 0 |
| − | S SKP 5 | + | S SKP 5 |
| − | ID LBF18303SC02 | + | ID LBF18303SC02 |
| − | FORMULA C18H30O2 | + | FORMULA C18H30O2 |
| − | EXACTMASS 278.224580204 | + | EXACTMASS 278.224580204 |
| − | AVERAGEMASS 278.4296 | + | AVERAGEMASS 278.4296 |
| − | SMILES CCC=CCC=CCC=CCCCCCCCC(O)=O | + | SMILES CCC=CCC=CCC=CCCCCCCCC(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/
20 19 0 0 0 0 0 0 0 0999 V2000
3.1102 -0.6566 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.6823 0.0309 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.2873 -0.6098 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.6823 0.7116 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.5602 0.0859 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0102 -0.6566 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.5152 0.0859 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0477 -0.7116 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6077 0.0859 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1402 -0.7116 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2998 0.0859 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7673 -0.6566 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1798 0.0859 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6748 -0.6566 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0598 0.0859 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5548 -0.6291 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.9948 0.0859 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.3798 -0.6291 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.8198 0.0859 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.2873 -0.6291 0.0000 C 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
2 4 2 0 0 0 0
1 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
9 10 1 0 0 0 0
10 11 1 0 0 0 0
11 12 2 0 0 0 0
12 13 1 0 0 0 0
13 14 1 0 0 0 0
15 14 2 0 0 0 0
15 16 1 0 0 0 0
16 17 1 0 0 0 0
17 18 2 0 0 0 0
18 19 1 0 0 0 0
20 19 1 0 0 0 0
S SKP 5
ID LBF18303SC02
FORMULA C18H30O2
EXACTMASS 278.224580204
AVERAGEMASS 278.4296
SMILES CCC=CCC=CCC=CCCCCCCCC(O)=O
M END
