Mol:BMFYS4CAe013
From Metabolomics.JP
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| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 13 12 0 0 1 0 0 0 0 0999 V2000 | + | 13 12 0 0 1 0 0 0 0 0999 V2000 |
| − | 4.7321 2.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.7321 2.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.7321 1.2500 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 | + | 4.7321 1.2500 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 |
| − | 3.8660 0.7500 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 | + | 3.8660 0.7500 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 |
| − | 3.8660 -0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.8660 -0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.8660 2.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.8660 2.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 5.5981 2.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 5.5981 2.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 5.5981 0.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 5.5981 0.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.0000 1.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.0000 1.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.0000 -0.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.0000 -0.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.0000 -1.7500 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.0000 -1.7500 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.0000 -1.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.0000 -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 | + | 2.0000 -1.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.0000 -2.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.0000 -2.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3 8 1 1 0 0 0 | + | 3 8 1 1 0 0 0 |
| − | 1 6 1 0 0 0 0 | + | 1 6 1 0 0 0 0 |
| − | 3 4 1 0 0 0 0 | + | 3 4 1 0 0 0 0 |
| − | 4 9 1 0 0 0 0 | + | 4 9 1 0 0 0 0 |
| − | 2 7 1 6 0 0 0 | + | 2 7 1 6 0 0 0 |
| − | 9 10 1 0 0 0 0 | + | 9 10 1 0 0 0 0 |
| − | 1 5 2 0 0 0 0 | + | 1 5 2 0 0 0 0 |
| − | 10 11 1 0 0 0 0 | + | 10 11 1 0 0 0 0 |
| − | 2 3 1 0 0 0 0 | + | 2 3 1 0 0 0 0 |
| − | 10 12 1 0 0 0 0 | + | 10 12 1 0 0 0 0 |
| − | 1 2 1 0 0 0 0 | + | 1 2 1 0 0 0 0 |
| − | 10 13 2 0 0 0 0 | + | 10 13 2 0 0 0 0 |
| − | S SKP 7 | + | S SKP 7 |
| − | ID BMFYS4CAe013 | + | ID BMFYS4CAe013 |
| − | NAME | + | NAME 2,3-Dihydroxy-4-phosphonooxybutanoic acid |
| − | FORMULA C4H9O8P | + | CAS_RN 57229-25-1 |
| − | EXACTMASS 216.0035 | + | FORMULA C4H9O8P |
| − | AVERAGEMASS 216.0832 | + | EXACTMASS 216.0035 |
| − | SMILES O[C@H](COP(O)(O)=O)[C@@H](O)C(O)=O | + | AVERAGEMASS 216.0832 |
| − | KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C03393 | + | SMILES O[C@H](COP(O)(O)=O)[C@@H](O)C(O)=O |
| + | KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C03393 | ||
M END | M END | ||
| − | |||
Latest revision as of 10:36, 17 June 2010
Copyright: ARM project http://www.metabolome.jp/
13 12 0 0 1 0 0 0 0 0999 V2000
4.7321 2.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.7321 1.2500 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0
3.8660 0.7500 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0
3.8660 -0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.8660 2.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
5.5981 2.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
5.5981 0.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.0000 1.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.0000 -0.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.0000 -1.7500 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0
4.0000 -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
3.0000 -2.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3 8 1 1 0 0 0
1 6 1 0 0 0 0
3 4 1 0 0 0 0
4 9 1 0 0 0 0
2 7 1 6 0 0 0
9 10 1 0 0 0 0
1 5 2 0 0 0 0
10 11 1 0 0 0 0
2 3 1 0 0 0 0
10 12 1 0 0 0 0
1 2 1 0 0 0 0
10 13 2 0 0 0 0
S SKP 7
ID BMFYS4CAe013
NAME 2,3-Dihydroxy-4-phosphonooxybutanoic acid
CAS_RN 57229-25-1
FORMULA C4H9O8P
EXACTMASS 216.0035
AVERAGEMASS 216.0832
SMILES O[C@H](COP(O)(O)=O)[C@@H](O)C(O)=O
KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C03393
M END
