Mol:LBF16204SC01
From Metabolomics.JP
(Difference between revisions)
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| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 18 17 0 0 0 0 0 0 0 0999 V2000 | + | 18 17 0 0 0 0 0 0 0 0999 V2000 |
| − | 3.7503 -0.6256 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.7503 -0.6256 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.3636 -0.1952 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.3636 -0.1952 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 5.0786 -0.6064 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 5.0786 -0.6064 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.3636 0.6325 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.3636 0.6325 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.2553 -0.1581 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.2553 -0.1581 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.5788 -0.6325 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.5788 -0.6325 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.9807 -0.0674 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.9807 -0.0674 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.3042 -0.5417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.3042 -0.5417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.7047 0.0248 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.7047 0.0248 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.0282 -0.4496 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.0282 -0.4496 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.5727 0.1183 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.5727 0.1183 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.2492 -0.3561 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.2492 -0.3561 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.8487 0.2104 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.8487 0.2104 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.5252 -0.2640 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.5252 -0.2640 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.1261 0.3039 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.1261 0.3039 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.8026 -0.1705 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.8026 -0.1705 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -4.4021 0.3960 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -4.4021 0.3960 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -5.0786 -0.0784 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -5.0786 -0.0784 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 |
| − | 14 15 2 0 0 0 0 | + | 14 15 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 1 0 0 0 0 | + | 17 18 1 0 0 0 0 |
| − | S SKP 5 | + | S SKP 5 |
| − | ID LBF16204SC01 | + | ID LBF16204SC01 |
| − | FORMULA C16H28O2 | + | FORMULA C16H28O2 |
| − | EXACTMASS 252.20893013999998 | + | EXACTMASS 252.20893013999998 |
| − | AVERAGEMASS 252.39231999999998 | + | AVERAGEMASS 252.39231999999998 |
| − | SMILES CCCC=CCC=CCCCCCCCC(O)=O | + | SMILES CCCC=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/
18 17 0 0 0 0 0 0 0 0999 V2000
3.7503 -0.6256 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.3636 -0.1952 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.0786 -0.6064 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.3636 0.6325 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.2553 -0.1581 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5788 -0.6325 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9807 -0.0674 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3042 -0.5417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7047 0.0248 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0282 -0.4496 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5727 0.1183 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.2492 -0.3561 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8487 0.2104 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5252 -0.2640 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.1261 0.3039 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.8026 -0.1705 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.4021 0.3960 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.0786 -0.0784 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
14 15 2 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
S SKP 5
ID LBF16204SC01
FORMULA C16H28O2
EXACTMASS 252.20893013999998
AVERAGEMASS 252.39231999999998
SMILES CCCC=CCC=CCCCCCCCC(O)=O
M END
