Mol:LBF18304SC02
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 |
| − | 3.2752 -0.6291 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.2752 -0.6291 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.8473 0.0584 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.8473 0.0584 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.4523 -0.5823 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.4523 -0.5823 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.8473 0.7391 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.8473 0.7391 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.7252 0.1134 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.7252 0.1134 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.1752 -0.6291 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.1752 -0.6291 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.6802 0.1134 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.6802 0.1134 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.2127 -0.6841 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.2127 -0.6841 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.7727 0.1134 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.7727 0.1134 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.3052 -0.6841 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.3052 -0.6841 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.1348 0.1134 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.1348 0.1134 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.6298 -0.6841 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.6298 -0.6841 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.1248 0.1134 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.1248 0.1134 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.7023 -0.7391 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.7023 -0.7391 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.1973 0.0584 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.1973 0.0584 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.6648 -0.7391 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.6648 -0.7391 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.0773 0.1134 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.0773 0.1134 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.5998 -0.7391 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.5998 -0.7391 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -4.0398 0.1134 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -4.0398 0.1134 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -4.4523 -0.6016 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -4.4523 -0.6016 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 2 0 0 0 0 | + | 16 17 2 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 |
| − | 20 19 1 0 0 0 0 | + | 20 19 1 0 0 0 0 |
| − | S SKP 5 | + | S SKP 5 |
| − | ID LBF18304SC02 | + | ID LBF18304SC02 |
| − | FORMULA C18H30O2 | + | FORMULA C18H30O2 |
| − | EXACTMASS 278.224580204 | + | EXACTMASS 278.224580204 |
| − | AVERAGEMASS 278.4296 | + | AVERAGEMASS 278.4296 |
| − | SMILES CCCC=CC=CCC=CCCCCCCCC(O)=O | + | SMILES CCCC=CC=CCC=CCCCCCCCC(O)=O |
M END | M END | ||
| − | |||
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
3.2752 -0.6291 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.8473 0.0584 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.4523 -0.5823 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.8473 0.7391 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.7252 0.1134 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1752 -0.6291 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6802 0.1134 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2127 -0.6841 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7727 0.1134 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3052 -0.6841 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1348 0.1134 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6298 -0.6841 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1248 0.1134 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7023 -0.7391 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1973 0.0584 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.6648 -0.7391 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.0773 0.1134 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.5998 -0.7391 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.0398 0.1134 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.4523 -0.6016 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 2 0 0 0 0
17 18 1 0 0 0 0
18 19 1 0 0 0 0
20 19 1 0 0 0 0
S SKP 5
ID LBF18304SC02
FORMULA C18H30O2
EXACTMASS 278.224580204
AVERAGEMASS 278.4296
SMILES CCCC=CC=CCC=CCCCCCCCC(O)=O
M END
