Mol:BMMCVA--0003
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 21 0 0 0 0 0 0 0 0999 V2000 | + | 21 21 0 0 0 0 0 0 0 0999 V2000 |
| − | 3.7321 3.8170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.7321 3.8170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.8660 4.3170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.8660 4.3170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.0000 3.8170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.0000 3.8170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.0000 2.8170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.0000 2.8170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.8660 2.3170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.8660 2.3170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.7321 2.8170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.7321 2.8170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.5981 2.3170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.5981 2.3170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.5981 1.3170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.5981 1.3170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 5.4641 0.8170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 5.4641 0.8170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 5.4641 -0.1830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 5.4641 -0.1830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 6.3301 -0.6830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 6.3301 -0.6830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 6.3301 -1.6830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 6.3301 -1.6830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 7.1962 -2.1830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 7.1962 -2.1830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 7.1962 -3.1830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 7.1962 -3.1830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 8.0622 -3.6830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 8.0622 -3.6830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.2321 4.6830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.2321 4.6830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.7321 3.8170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.7321 3.8170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.8660 1.3170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.8660 1.3170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 6.3301 1.3170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 6.3301 1.3170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 8.0622 -1.6830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 8.0622 -1.6830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 8.0622 -4.6830 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 8.0622 -4.6830 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2 1 1 0 0 0 0 | + | 2 1 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 |
| − | 4 5 1 0 0 0 0 | + | 4 5 1 0 0 0 0 |
| − | 5 6 2 0 0 0 0 | + | 5 6 2 0 0 0 0 |
| − | 6 1 1 0 0 0 0 | + | 6 1 1 0 0 0 0 |
| − | 6 7 1 0 0 0 0 | + | 6 7 1 0 0 0 0 |
| − | 7 8 2 0 0 0 0 | + | 7 8 2 0 0 0 0 |
| − | 8 9 1 0 0 0 0 | + | 8 9 1 0 0 0 0 |
| − | 9 10 2 0 0 0 0 | + | 9 10 2 0 0 0 0 |
| − | 9 19 1 0 0 0 0 | + | 9 19 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 20 1 0 0 0 0 | + | 13 20 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 |
| − | 1 17 1 0 0 0 0 | + | 1 17 1 0 0 0 0 |
| − | 5 18 1 0 0 0 0 | + | 5 18 1 0 0 0 0 |
| − | 15 21 2 0 0 0 0 | + | 15 21 2 0 0 0 0 |
| − | 1 16 1 0 0 0 0 | + | 1 16 1 0 0 0 0 |
| − | S SKP 7 | + | S SKP 7 |
| − | ID BMMCVA--0003 | + | ID BMMCVA--0003 |
| − | NAME Retinal | + | NAME Retinal |
| − | FORMULA C20H28O | + | FORMULA C20H28O |
| − | EXACTMASS 284.214 | + | EXACTMASS 284.214 |
| − | AVERAGEMASS 284.4357 | + | AVERAGEMASS 284.4357 |
| − | SMILES CC(=CC=CC(=CC=O)C)C=CC(C1(C)C)=C(C)CCC1 | + | SMILES CC(=CC=CC(=CC=O)C)C=CC(C1(C)C)=C(C)CCC1 |
| − | KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C00376 | + | KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C00376 |
M END | M END | ||
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Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/
21 21 0 0 0 0 0 0 0 0999 V2000
3.7321 3.8170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 4.3170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 3.8170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 2.8170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 2.3170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7321 2.8170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 2.3170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 1.3170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 0.8170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 -0.1830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.3301 -0.6830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.3301 -1.6830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.1962 -2.1830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.1962 -3.1830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.0622 -3.6830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.2321 4.6830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.7321 3.8170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 1.3170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.3301 1.3170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.0622 -1.6830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.0622 -4.6830 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2 1 1 0 0 0 0
2 3 1 0 0 0 0
3 4 1 0 0 0 0
4 5 1 0 0 0 0
5 6 2 0 0 0 0
6 1 1 0 0 0 0
6 7 1 0 0 0 0
7 8 2 0 0 0 0
8 9 1 0 0 0 0
9 10 2 0 0 0 0
9 19 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 20 1 0 0 0 0
13 14 2 0 0 0 0
14 15 1 0 0 0 0
1 17 1 0 0 0 0
5 18 1 0 0 0 0
15 21 2 0 0 0 0
1 16 1 0 0 0 0
S SKP 7
ID BMMCVA--0003
NAME Retinal
FORMULA C20H28O
EXACTMASS 284.214
AVERAGEMASS 284.4357
SMILES CC(=CC=CC(=CC=O)C)C=CC(C1(C)C)=C(C)CCC1
KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C00376
M END
