Mol:BMFYS4KTe003
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 1 0 0 0 0 0999 V2000 | + | 11 10 0 0 1 0 0 0 0 0999 V2000 |
| − | 3.7321 2.1830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.7321 2.1830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.5981 1.6830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.5981 1.6830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.5981 0.6830 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 | + | 4.5981 0.6830 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 |
| − | 3.7321 0.1830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.7321 0.1830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 5.4641 2.1830 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 5.4641 2.1830 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 5.4641 0.1830 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 5.4641 0.1830 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.7321 -0.8170 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.7321 -0.8170 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.8660 -1.3170 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.8660 -1.3170 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.3660 -0.4510 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.3660 -0.4510 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.0000 -1.8170 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.0000 -1.8170 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.3660 -2.1830 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.3660 -2.1830 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1 2 1 0 0 0 0 | + | 1 2 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 7 1 0 0 0 0 | + | 4 7 1 0 0 0 0 |
| − | 2 5 2 0 0 0 0 | + | 2 5 2 0 0 0 0 |
| − | 3 6 1 4 0 0 0 | + | 3 6 1 4 0 0 0 |
| − | 7 8 1 0 0 0 0 | + | 7 8 1 0 0 0 0 |
| − | 8 9 1 0 0 0 0 | + | 8 9 1 0 0 0 0 |
| − | 8 11 2 0 0 0 0 | + | 8 11 2 0 0 0 0 |
| − | 8 10 1 0 0 0 0 | + | 8 10 1 0 0 0 0 |
| − | S SKP | + | S SKP 7 |
| − | ID BMFYS4KTe003 | + | ID BMFYS4KTe003 |
| − | NAME | + | NAME (2-Hydroxy-3-oxobutyl) dihydrogen phosphate |
| − | FORMULA C4H9O6P | + | CAS_RN 114155-98-5 |
| − | EXACTMASS 184.0136 | + | FORMULA C4H9O6P |
| − | AVERAGEMASS 184.0844 | + | EXACTMASS 184.0136 |
| − | SMILES CC(=O)C(O)COP(O)(O)=O | + | AVERAGEMASS 184.0844 |
| + | SMILES CC(=O)C(O)COP(O)(O)=O | ||
M END | M END | ||
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Latest revision as of 11:46, 17 June 2010
Copyright: ARM project http://www.metabolome.jp/
11 10 0 0 1 0 0 0 0 0999 V2000
3.7321 2.1830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 1.6830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 0.6830 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0
3.7321 0.1830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 2.1830 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 0.1830 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.7321 -0.8170 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -1.3170 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0
2.3660 -0.4510 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -1.8170 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.3660 -2.1830 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1 2 1 0 0 0 0
2 3 1 0 0 0 0
3 4 1 0 0 0 0
4 7 1 0 0 0 0
2 5 2 0 0 0 0
3 6 1 4 0 0 0
7 8 1 0 0 0 0
8 9 1 0 0 0 0
8 11 2 0 0 0 0
8 10 1 0 0 0 0
S SKP 7
ID BMFYS4KTe003
NAME (2-Hydroxy-3-oxobutyl) dihydrogen phosphate
CAS_RN 114155-98-5
FORMULA C4H9O6P
EXACTMASS 184.0136
AVERAGEMASS 184.0844
SMILES CC(=O)C(O)COP(O)(O)=O
M END
