Mol:LBF18403SC01
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 0 0 0 0 0 0999 V2000 | + | 20 19 0 0 0 0 0 0 0 0999 V2000 |
| − | 4.0659 -0.7253 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.0659 -0.7253 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.6241 0.1272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.6241 0.1272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 5.1191 -0.6236 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 5.1191 -0.6236 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.6241 0.7253 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.6241 0.7253 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.4609 0.1272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.4609 0.1272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.8559 -0.6153 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.8559 -0.6153 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.2784 0.1272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.2784 0.1272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.6184 -0.6772 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.6184 -0.6772 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.0134 0.1272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.0134 0.1272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.4359 -0.6153 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.4359 -0.6153 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.1691 0.1547 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.1691 0.1547 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.7191 0.1656 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.7191 0.1656 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.2691 -0.6153 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.2691 -0.6153 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.8191 0.1272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.8191 0.1272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.4791 0.1272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.4791 0.1272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.0566 -0.6153 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.0566 -0.6153 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.6066 0.1272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.6066 0.1272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -4.1841 0.1272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -4.1841 0.1272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -4.7066 -0.6153 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -4.7066 -0.6153 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -5.1191 0.0997 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -5.1191 0.0997 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 2 0 0 0 0 | + | 5 6 2 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 2 0 0 0 0 | + | 17 18 2 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 |
| − | S SKP 5 | + | S SKP 5 |
| − | ID LBF18403SC01 | + | ID LBF18403SC01 |
| − | FORMULA C18H28O2 | + | FORMULA C18H28O2 |
| − | EXACTMASS 276.20893014 | + | EXACTMASS 276.20893014 |
| − | AVERAGEMASS 276.41372 | + | AVERAGEMASS 276.41372 |
| − | SMILES CCC=CCC=CCC=CCCCCC=CCC(O)=O | + | SMILES CCC=CCC=CCC=CCCCCC=CCC(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/
20 19 0 0 0 0 0 0 0 0999 V2000
4.0659 -0.7253 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.6241 0.1272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.1191 -0.6236 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.6241 0.7253 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.4609 0.1272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8559 -0.6153 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2784 0.1272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6184 -0.6772 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0134 0.1272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4359 -0.6153 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1691 0.1547 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7191 0.1656 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.2691 -0.6153 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8191 0.1272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4791 0.1272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.0566 -0.6153 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.6066 0.1272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.1841 0.1272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.7066 -0.6153 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.1191 0.0997 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 2 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 2 0 0 0 0
18 19 1 0 0 0 0
19 20 1 0 0 0 0
S SKP 5
ID LBF18403SC01
FORMULA C18H28O2
EXACTMASS 276.20893014
AVERAGEMASS 276.41372
SMILES CCC=CCC=CCC=CCCCCC=CCC(O)=O
M END
