Mol:LBF20109SC02
From Metabolomics.JP
(Difference between revisions)
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| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 22 21 0 0 0 0 0 0 0 0999 V2000 | + | 22 21 0 0 0 0 0 0 0 0999 V2000 |
| − | 3.3234 0.1547 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.3234 0.1547 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.9366 0.5851 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.9366 0.5851 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.6516 0.1739 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.6516 0.1739 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.9366 1.4128 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.9366 1.4128 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.7184 0.6222 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.7184 0.6222 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.0419 0.1478 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.0419 0.1478 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.3901 0.6511 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.3901 0.6511 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.7136 0.1767 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.7136 0.1767 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.0591 0.6813 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.0591 0.6813 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.6174 0.2069 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.6174 0.2069 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.2691 0.7102 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.2691 0.7102 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.9456 0.2358 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.9456 0.2358 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.6001 0.7404 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.6001 0.7404 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.2766 0.2661 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.2766 0.2661 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.9641 0.7872 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.9641 0.7872 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -4.6516 0.2358 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -4.6516 0.2358 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -4.6516 -0.8903 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -4.6516 -0.8903 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.9641 -1.4128 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.9641 -1.4128 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.2766 -0.8353 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.2766 -0.8353 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.6208 -1.3331 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.6208 -1.3331 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.9883 -0.8009 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.9883 -0.8009 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.3296 -1.3001 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.3296 -1.3001 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 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 2 0 0 0 0 | + | 13 14 2 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 |
| − | 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 |
| − | 20 21 1 0 0 0 0 | + | 20 21 1 0 0 0 0 |
| − | 22 21 1 0 0 0 0 | + | 22 21 1 0 0 0 0 |
| − | S SKP 5 | + | S SKP 5 |
| − | ID LBF20109SC02 | + | ID LBF20109SC02 |
| − | FORMULA C20H38O2 | + | FORMULA C20H38O2 |
| − | EXACTMASS 310.28718046 | + | EXACTMASS 310.28718046 |
| − | AVERAGEMASS 310.51452 | + | AVERAGEMASS 310.51452 |
| − | SMILES C(CCCCC=CCCCCCCCCCC(O)=O)CCC | + | SMILES C(CCCCC=CCCCCCCCCCC(O)=O)CCC |
M END | M END | ||
| − | |||
Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/
22 21 0 0 0 0 0 0 0 0999 V2000
3.3234 0.1547 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.9366 0.5851 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.6516 0.1739 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.9366 1.4128 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.7184 0.6222 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0419 0.1478 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3901 0.6511 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7136 0.1767 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0591 0.6813 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6174 0.2069 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.2691 0.7102 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9456 0.2358 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.6001 0.7404 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.2766 0.2661 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.9641 0.7872 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.6516 0.2358 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.6516 -0.8903 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.9641 -1.4128 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.2766 -0.8353 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.6208 -1.3331 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9883 -0.8009 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3296 -1.3001 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 1 0 0 0 0
12 13 1 0 0 0 0
13 14 2 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
18 19 1 0 0 0 0
19 20 1 0 0 0 0
20 21 1 0 0 0 0
22 21 1 0 0 0 0
S SKP 5
ID LBF20109SC02
FORMULA C20H38O2
EXACTMASS 310.28718046
AVERAGEMASS 310.51452
SMILES C(CCCCC=CCCCCCCCCCC(O)=O)CCC
M END
