Mol:LBF18306SC02
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 |
| − | 3.1515 -0.6566 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.1515 -0.6566 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.7235 0.0309 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.7235 0.0309 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.3285 -0.6098 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.3285 -0.6098 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.7235 0.7116 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.7235 0.7116 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.6015 0.0859 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.6015 0.0859 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.0515 -0.6566 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.0515 -0.6566 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.5565 0.0859 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.5565 0.0859 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.0890 -0.7116 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.0890 -0.7116 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.5940 -0.7116 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.5940 -0.7116 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.1540 0.0859 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.1540 0.0859 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.2860 -0.7116 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.2860 -0.7116 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.8085 -0.7116 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.8085 -0.7116 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.2210 0.0859 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.2210 0.0859 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.7160 -0.7116 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.7160 -0.7116 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.2660 -0.7116 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.2660 -0.7116 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.6785 0.0034 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.6785 0.0034 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.0910 -0.7116 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.0910 -0.7116 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.5035 0.0034 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.5035 0.0034 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.9160 -0.7116 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.9160 -0.7116 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -4.3285 0.0034 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -4.3285 0.0034 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 2 0 0 0 0 | + | 8 9 2 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 |
| − | 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 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 |
| − | 19 20 1 0 0 0 0 | + | 19 20 1 0 0 0 0 |
| − | 11 12 2 0 0 0 0 | + | 11 12 2 0 0 0 0 |
| − | 15 14 2 0 0 0 0 | + | 15 14 2 0 0 0 0 |
| − | S SKP 5 | + | S SKP 5 |
| − | ID LBF18306SC02 | + | ID LBF18306SC02 |
| − | FORMULA C18H30O2 | + | FORMULA C18H30O2 |
| − | EXACTMASS 278.224580204 | + | EXACTMASS 278.224580204 |
| − | AVERAGEMASS 278.4296 | + | AVERAGEMASS 278.4296 |
| − | SMILES CCCCCC=CCC=CCC=CCCCCC(O)=O | + | SMILES CCCCCC=CCC=CCC=CCCCCC(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
3.1515 -0.6566 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7235 0.0309 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.3285 -0.6098 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.7235 0.7116 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.6015 0.0859 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0515 -0.6566 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.5565 0.0859 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0890 -0.7116 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5940 -0.7116 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1540 0.0859 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2860 -0.7116 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8085 -0.7116 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.2210 0.0859 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7160 -0.7116 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.2660 -0.7116 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.6785 0.0034 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.0910 -0.7116 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.5035 0.0034 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.9160 -0.7116 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.3285 0.0034 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 2 0 0 0 0
9 10 1 0 0 0 0
10 11 1 0 0 0 0
12 13 1 0 0 0 0
13 14 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
19 20 1 0 0 0 0
11 12 2 0 0 0 0
15 14 2 0 0 0 0
S SKP 5
ID LBF18306SC02
FORMULA C18H30O2
EXACTMASS 278.224580204
AVERAGEMASS 278.4296
SMILES CCCCCC=CCC=CCC=CCCCCC(O)=O
M END
