Mol:LBF17000BC01
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 1 0 0 0 0 0999 V2000 | + | 20 19 0 0 1 0 0 0 0 0999 V2000 |
| − | -3.9243 -0.3740 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.9243 -0.3740 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -4.5073 0.2090 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -4.5073 0.2090 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -5.0902 -0.3740 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -5.0902 -0.3740 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.3413 0.2090 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.3413 0.2090 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.7583 -0.3740 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.7583 -0.3740 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.1752 0.2090 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.1752 0.2090 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.5923 -0.3740 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.5923 -0.3740 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.0093 0.2090 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 | + | -1.0093 0.2090 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 |
| − | -0.4263 -0.3740 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.4263 -0.3740 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.1567 0.2090 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.1567 0.2090 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.7398 -0.3740 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.7398 -0.3740 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.3227 0.2090 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.3227 0.2090 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.9071 -0.3754 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.9071 -0.3754 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.4901 0.2076 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.4901 0.2076 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.0731 -0.3754 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.0731 -0.3754 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.6560 0.2076 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.6560 0.2076 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.3738 -0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.3738 -0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.3766 -1.0340 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.3766 -1.0340 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 5.0902 0.2090 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 5.0902 0.2090 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.0093 1.0340 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.0093 1.0340 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2 1 1 0 0 0 0 | + | 2 1 1 0 0 0 0 |
| − | 2 3 1 0 0 0 0 | + | 2 3 1 0 0 0 0 |
| − | 4 1 1 0 0 0 0 | + | 4 1 1 0 0 0 0 |
| − | 4 5 1 0 0 0 0 | + | 4 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 1 0 0 0 0 | + | 11 12 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 14 1 0 0 0 0 | + | 15 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 |
| − | 17 19 2 0 0 0 0 | + | 17 19 2 0 0 0 0 |
| − | 8 20 1 4 0 0 0 | + | 8 20 1 4 0 0 0 |
| − | S SKP 5 | + | S SKP 5 |
| − | ID LBF17000BC01 | + | ID LBF17000BC01 |
| − | FORMULA C18H36O2 | + | FORMULA C18H36O2 |
| − | EXACTMASS 284.271530396 | + | EXACTMASS 284.271530396 |
| − | AVERAGEMASS 284.47724 | + | AVERAGEMASS 284.47724 |
| − | SMILES CCCCCCCC(C)CCCCCCCCC(O)=O | + | SMILES CCCCCCCC(C)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 1 0 0 0 0 0999 V2000
-3.9243 -0.3740 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.5073 0.2090 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.0902 -0.3740 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.3413 0.2090 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.7583 -0.3740 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1752 0.2090 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5923 -0.3740 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0093 0.2090 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0
-0.4263 -0.3740 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1567 0.2090 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7398 -0.3740 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3227 0.2090 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9071 -0.3754 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4901 0.2076 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.0731 -0.3754 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.6560 0.2076 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.3738 -0.2062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.3766 -1.0340 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
5.0902 0.2090 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.0093 1.0340 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2 1 1 0 0 0 0
2 3 1 0 0 0 0
4 1 1 0 0 0 0
4 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 1 0 0 0 0
12 13 1 0 0 0 0
13 14 1 0 0 0 0
15 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
17 19 2 0 0 0 0
8 20 1 4 0 0 0
S SKP 5
ID LBF17000BC01
FORMULA C18H36O2
EXACTMASS 284.271530396
AVERAGEMASS 284.47724
SMILES CCCCCCCC(C)CCCCCCCCC(O)=O
M END
