Mol:BMFYB4SAr001
From Metabolomics.JP
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| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 10 9 0 0 1 0 0 0 0 0999 V2000 | + | 10 9 0 0 1 0 0 0 0 0999 V2000 |
| − | 3.7321 1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.7321 1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.7321 0.2500 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 | + | 3.7321 0.2500 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 |
| − | 2.8660 -0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.8660 -0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.0000 -0.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.0000 -0.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.3660 0.6160 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.3660 0.6160 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.3660 -1.1160 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.3660 -1.1160 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.5981 1.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.5981 1.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.8660 1.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.8660 1.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.5981 -0.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.5981 -0.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.0000 -1.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.0000 -1.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4 3 1 0 0 0 0 | + | 4 3 1 0 0 0 0 |
| − | 4 10 2 0 0 0 0 | + | 4 10 2 0 0 0 0 |
| − | 3 5 1 0 0 0 0 | + | 3 5 1 0 0 0 0 |
| − | 3 6 1 0 0 0 0 | + | 3 6 1 0 0 0 0 |
| − | 3 2 1 0 0 0 0 | + | 3 2 1 0 0 0 0 |
| − | 2 9 1 6 0 0 0 | + | 2 9 1 6 0 0 0 |
| − | 1 7 1 0 0 0 0 | + | 1 7 1 0 0 0 0 |
| − | 1 8 2 0 0 0 0 | + | 1 8 2 0 0 0 0 |
| − | 2 1 1 0 0 0 0 | + | 2 1 1 0 0 0 0 |
| − | S SKP 7 | + | S SKP 7 |
| − | ID BMFYB4SAr001 | + | ID BMFYB4SAr001 |
| − | NAME | + | NAME 2-Hydroxy- 3,3-dimethyl-4-oxobutanoic acid |
| − | FORMULA C6H10O4 | + | CAS_RN 7300-60-9 |
| − | EXACTMASS 146.0579 | + | FORMULA C6H10O4 |
| − | AVERAGEMASS 146.1412 | + | EXACTMASS 146.0579 |
| − | SMILES O=CC(C)(C)[C@@H](O)C(O)=O | + | AVERAGEMASS 146.1412 |
| − | KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C01053 | + | SMILES O=CC(C)(C)[C@@H](O)C(O)=O |
| + | KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C01053 | ||
M END | M END | ||
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Latest revision as of 17:39, 16 June 2010
Copyright: ARM project http://www.metabolome.jp/
10 9 0 0 1 0 0 0 0 0999 V2000
3.7321 1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7321 0.2500 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0
2.8660 -0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -0.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3660 0.6160 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.3660 -1.1160 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 1.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 1.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 -0.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -1.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4 3 1 0 0 0 0
4 10 2 0 0 0 0
3 5 1 0 0 0 0
3 6 1 0 0 0 0
3 2 1 0 0 0 0
2 9 1 6 0 0 0
1 7 1 0 0 0 0
1 8 2 0 0 0 0
2 1 1 0 0 0 0
S SKP 7
ID BMFYB4SAr001
NAME 2-Hydroxy- 3,3-dimethyl-4-oxobutanoic acid
CAS_RN 7300-60-9
FORMULA C6H10O4
EXACTMASS 146.0579
AVERAGEMASS 146.1412
SMILES O=CC(C)(C)[C@@H](O)C(O)=O
KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C01053
M END
