Mol:LBF16000HO01
From Metabolomics.JP
(Difference between revisions)
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| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 19 18 0 0 1 0 0 0 0 0999 V2000 | + | 19 18 0 0 1 0 0 0 0 0999 V2000 |
| − | 3.0949 0.3203 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.0949 0.3203 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.6778 -0.2627 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 | + | 3.6778 -0.2627 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 |
| − | 4.3049 0.3203 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.3049 0.3203 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.8920 -0.1788 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.8920 -0.1788 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.3103 1.0875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.3103 1.0875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.5119 -0.2627 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.5119 -0.2627 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.9289 0.3203 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.9289 0.3203 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.3458 -0.2627 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.3458 -0.2627 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.7628 0.3203 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.7628 0.3203 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.1799 -0.2627 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.1799 -0.2627 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.4031 0.3203 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.4031 0.3203 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.9861 -0.2627 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.9861 -0.2627 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.5967 0.4028 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.5967 0.4028 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.3450 -0.3730 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.3450 -0.3730 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.9284 0.2103 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.9284 0.2103 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.5118 -0.3730 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.5118 -0.3730 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -4.0951 0.2103 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -4.0951 0.2103 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -4.8920 -0.0032 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -4.8920 -0.0032 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.6628 -1.0875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.6628 -1.0875 0.0000 O 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 |
| − | 3 4 1 0 0 0 0 | + | 3 4 1 0 0 0 0 |
| − | 3 5 2 0 0 0 0 | + | 3 5 2 0 0 0 0 |
| − | 1 6 1 0 0 0 0 | + | 1 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 |
| − | 14 15 1 0 0 0 0 | + | 14 15 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 |
| − | 2 19 1 4 0 0 0 | + | 2 19 1 4 0 0 0 |
| − | S SKP 5 | + | S SKP 5 |
| − | ID LBF16000HO01 | + | ID LBF16000HO01 |
| − | FORMULA C16H32O3 | + | FORMULA C16H32O3 |
| − | EXACTMASS 272.23514489 | + | EXACTMASS 272.23514489 |
| − | AVERAGEMASS 272.42348 | + | AVERAGEMASS 272.42348 |
| − | SMILES CCCCCCCCCCCCCCC(O)C(O)=O | + | SMILES CCCCCCCCCCCCCCC(O)C(O)=O |
M END | M END | ||
| − | |||
Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/
19 18 0 0 1 0 0 0 0 0999 V2000
3.0949 0.3203 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.6778 -0.2627 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0
4.3049 0.3203 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.8920 -0.1788 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.3103 1.0875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.5119 -0.2627 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9289 0.3203 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3458 -0.2627 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7628 0.3203 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1799 -0.2627 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4031 0.3203 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.9861 -0.2627 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5967 0.4028 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3450 -0.3730 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.9284 0.2103 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.5118 -0.3730 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.0951 0.2103 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.8920 -0.0032 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.6628 -1.0875 0.0000 O 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
3 4 1 0 0 0 0
3 5 2 0 0 0 0
1 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
14 15 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
2 19 1 4 0 0 0
S SKP 5
ID LBF16000HO01
FORMULA C16H32O3
EXACTMASS 272.23514489
AVERAGEMASS 272.42348
SMILES CCCCCCCCCCCCCCC(O)C(O)=O
M END
