Mol:BMFYB5CAr007
From Metabolomics.JP
(Difference between revisions)
| (One intermediate revision by one user not shown) | |||
| Line 1: | Line 1: | ||
| − | + | ||
| − | + | ||
| − | 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 0 0 0 0 0 0 0 0 0 0 | + | 3.7321 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 1 0 0 0 0 0 0 0 0 0 | + | 2.8660 -0.2500 0.0000 C 0 0 1 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 |
| − | 2.0000 -1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.0000 -1.7500 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 |
| − | 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 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 |
| − | 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 |
| − | 3.3660 -1.1160 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.3660 -1.1160 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1 7 1 0 0 0 0 | + | 1 7 1 0 0 0 0 |
| − | 1 2 1 0 0 0 0 | + | 1 2 1 0 0 0 0 |
| − | 1 8 2 0 0 0 0 | + | 1 8 2 0 0 0 0 |
| − | 2 3 1 0 0 0 0 | + | 2 3 1 0 0 0 0 |
| − | 2 9 2 0 0 0 0 | + | 2 9 2 0 0 0 0 |
| − | 3 6 1 6 0 0 0 | + | 3 6 1 6 0 0 0 |
| − | 3 10 1 1 0 0 0 | + | 3 10 1 1 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 |
| − | S SKP 7 | + | S SKP 7 |
| − | ID BMFYB5CAr007 | + | ID BMFYB5CAr007 |
| − | NAME | + | NAME 3-Hydroxy-3-methyl-2-oxopentanoic acid |
| − | FORMULA C6H10O4 | + | CAS_RN 17125-32-5 |
| − | EXACTMASS 146.0579 | + | FORMULA C6H10O4 |
| − | AVERAGEMASS 146.1412 | + | EXACTMASS 146.0579 |
| − | SMILES CC[C@](C)(O)C(=O)C(O)=O | + | AVERAGEMASS 146.1412 |
| − | KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C06005 | + | SMILES CC[C@](C)(O)C(=O)C(O)=O |
| + | KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C06005 | ||
M END | M END | ||
| − | |||
Latest revision as of 17:46, 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 0 0 0 0 0 0 0 0 0 0
2.8660 -0.2500 0.0000 C 0 0 1 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 -1.7500 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
2.8660 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
4.5981 -0.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.3660 -1.1160 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1 7 1 0 0 0 0
1 2 1 0 0 0 0
1 8 2 0 0 0 0
2 3 1 0 0 0 0
2 9 2 0 0 0 0
3 6 1 6 0 0 0
3 10 1 1 0 0 0
3 4 1 0 0 0 0
4 5 1 0 0 0 0
S SKP 7
ID BMFYB5CAr007
NAME 3-Hydroxy-3-methyl-2-oxopentanoic acid
CAS_RN 17125-32-5
FORMULA C6H10O4
EXACTMASS 146.0579
AVERAGEMASS 146.1412
SMILES CC[C@](C)(O)C(=O)C(O)=O
KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C06005
M END
