Mol:LBF19117SC01
From Metabolomics.JP
(Difference between revisions)
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| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 21 20 0 0 0 0 0 0 0 0999 V2000 | + | 21 20 0 0 0 0 0 0 0 0999 V2000 |
| − | 4.9706 -0.5947 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.9706 -0.5947 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 5.5839 -0.1643 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 5.5839 -0.1643 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 6.2989 -0.5754 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 6.2989 -0.5754 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 5.5839 0.6634 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 5.5839 0.6634 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.4581 -0.6497 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.4581 -0.6497 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.8064 -0.1464 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.8064 -0.1464 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.1436 -0.6359 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.1436 -0.6359 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.5070 -0.1822 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.5070 -0.1822 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.8731 -0.6359 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.8731 -0.6359 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.2956 -0.1822 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.2956 -0.1822 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.3768 -0.6634 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.3768 -0.6634 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.0244 -0.1547 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.0244 -0.1547 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.6940 -0.6346 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.6940 -0.6346 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.3444 -0.1244 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.3444 -0.1244 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.0140 -0.6043 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.0140 -0.6043 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.6616 -0.0956 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.6616 -0.0956 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -4.3312 -0.5754 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -4.3312 -0.5754 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -4.9816 -0.0653 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -4.9816 -0.0653 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.2226 -0.2468 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.2226 -0.2468 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -5.6512 -0.5452 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -5.6512 -0.5452 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -6.2989 -0.0364 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -6.2989 -0.0364 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 |
| − | 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 |
| − | 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 |
| − | 1 19 2 0 0 0 0 | + | 1 19 2 0 0 0 0 |
| − | 5 19 1 0 0 0 0 | + | 5 19 1 0 0 0 0 |
| − | 20 18 1 0 0 0 0 | + | 20 18 1 0 0 0 0 |
| − | 20 21 1 0 0 0 0 | + | 20 21 1 0 0 0 0 |
| − | S SKP 5 | + | S SKP 5 |
| − | ID LBF19117SC01 | + | ID LBF19117SC01 |
| − | FORMULA C19H36O2 | + | FORMULA C19H36O2 |
| − | EXACTMASS 296.271530396 | + | EXACTMASS 296.271530396 |
| − | AVERAGEMASS 296.48794000000004 | + | AVERAGEMASS 296.48794000000004 |
| − | SMILES CCCCCCCCCCCCCCCCC=CC(O)=O | + | SMILES CCCCCCCCCCCCCCCCC=CC(O)=O |
M END | M END | ||
| − | |||
Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/
21 20 0 0 0 0 0 0 0 0999 V2000
4.9706 -0.5947 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.5839 -0.1643 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.2989 -0.5754 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
5.5839 0.6634 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.4581 -0.6497 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8064 -0.1464 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1436 -0.6359 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.5070 -0.1822 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8731 -0.6359 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2956 -0.1822 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3768 -0.6634 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0244 -0.1547 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6940 -0.6346 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3444 -0.1244 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.0140 -0.6043 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.6616 -0.0956 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.3312 -0.5754 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.9816 -0.0653 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.2226 -0.2468 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.6512 -0.5452 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-6.2989 -0.0364 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
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
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
1 19 2 0 0 0 0
5 19 1 0 0 0 0
20 18 1 0 0 0 0
20 21 1 0 0 0 0
S SKP 5
ID LBF19117SC01
FORMULA C19H36O2
EXACTMASS 296.271530396
AVERAGEMASS 296.48794000000004
SMILES CCCCCCCCCCCCCCCCC=CC(O)=O
M END
