Mol:BMFYB6SAr002
From Metabolomics.JP
(Difference between revisions)
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| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 11 10 0 0 0 0 0 0 0 0 1 V2000 | + | 11 10 0 0 0 0 0 0 0 0 1 V2000 |
| − | 18.6754 -6.0039 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 18.6754 -6.0039 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 16.8011 -7.0860 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 16.8011 -7.0860 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 16.8011 -9.2504 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 16.8011 -9.2504 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 18.6755 -10.3325 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 18.6755 -10.3325 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 18.6755 -12.4968 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 18.6755 -12.4968 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 16.8011 -13.5790 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 16.8011 -13.5790 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 20.5498 -13.5790 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 20.5498 -13.5790 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 20.5497 -7.0860 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 20.5497 -7.0860 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 18.6754 -3.8395 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 18.6754 -3.8395 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 14.9266 -6.0039 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 14.9266 -6.0039 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 16.8011 -15.7433 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 16.8011 -15.7433 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 |
| − | 6 5 1 0 0 0 0 | + | 6 5 1 0 0 0 0 |
| − | 1 8 1 0 0 0 0 | + | 1 8 1 0 0 0 0 |
| − | 4 3 1 0 0 0 0 | + | 4 3 1 0 0 0 0 |
| − | 2 10 1 0 0 0 0 | + | 2 10 1 0 0 0 0 |
| − | 5 7 1 0 0 0 0 | + | 5 7 1 0 0 0 0 |
| − | 3 2 2 0 0 0 0 | + | 3 2 2 0 0 0 0 |
| − | 6 11 2 0 0 0 0 | + | 6 11 2 0 0 0 0 |
| − | 5 4 2 0 0 0 0 | + | 5 4 2 0 0 0 0 |
| − | 1 9 2 0 0 0 0 | + | 1 9 2 0 0 0 0 |
| − | S SKP | + | S SKP 8 |
| − | ID BMFYB6SAr002 | + | AUTODRAW false |
| − | NAME 2-Hydroxy-5-methyl- | + | ID BMFYB6SAr002 |
| − | FORMULA C7H8O4 | + | NAME (2E,4Z) -2-Hydroxy-5-methyl-6-oxohexa-2,4-dienoic acid |
| − | EXACTMASS 156.0422 | + | CAS_RN 173325-11-6 |
| − | AVERAGEMASS 156.136 | + | FORMULA C7H8O4 |
| − | SMILES O=CC(C)=CC=C(O)C(O)=O | + | EXACTMASS 156.0422 |
| − | KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C06760 | + | AVERAGEMASS 156.136 |
| + | SMILES O=CC(C)=CC=C(O)C(O)=O | ||
| + | KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C06760 | ||
M END | M END | ||
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Latest revision as of 17:58, 16 June 2010
Copyright: ARM project http://www.metabolome.jp/ 11 10 0 0 0 0 0 0 0 0 1 V2000 18.6754 -6.0039 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8011 -7.0860 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8011 -9.2504 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.6755 -10.3325 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.6755 -12.4968 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8011 -13.5790 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.5498 -13.5790 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.5497 -7.0860 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 18.6754 -3.8395 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.9266 -6.0039 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.8011 -15.7433 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2 1 1 0 0 0 0 6 5 1 0 0 0 0 1 8 1 0 0 0 0 4 3 1 0 0 0 0 2 10 1 0 0 0 0 5 7 1 0 0 0 0 3 2 2 0 0 0 0 6 11 2 0 0 0 0 5 4 2 0 0 0 0 1 9 2 0 0 0 0 S SKP 8 AUTODRAW false ID BMFYB6SAr002 NAME (2E,4Z) -2-Hydroxy-5-methyl-6-oxohexa-2,4-dienoic acid CAS_RN 173325-11-6 FORMULA C7H8O4 EXACTMASS 156.0422 AVERAGEMASS 156.136 SMILES O=CC(C)=CC=C(O)C(O)=O KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C06760 M END
