Mol:BMFYB3OHe001
From Metabolomics.JP
(Difference between revisions)
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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 |
| − | 5.4641 2.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 5.4641 2.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 5.4641 1.7500 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 | + | 5.4641 1.7500 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 |
| − | 4.5981 1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.5981 1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.8660 -1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.8660 -1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.0000 -2.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.0000 -2.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.0000 -3.2500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.0000 -3.2500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 6.3301 3.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 6.3301 3.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 6.3301 1.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 6.3301 1.2500 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 | + | 4.5981 0.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.7321 -0.2500 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.7321 -0.2500 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.2321 0.6160 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.2321 0.6160 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.2321 -1.1160 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.2321 -1.1160 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.8660 -0.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.8660 -0.7500 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 |
| − | 1 7 1 0 0 0 0 | + | 1 7 1 0 0 0 0 |
| − | 2 8 1 1 0 0 0 | + | 2 8 1 1 0 0 0 |
| − | 3 9 1 0 0 0 0 | + | 3 9 1 0 0 0 0 |
| − | 9 10 1 0 0 0 0 | + | 9 10 1 0 0 0 0 |
| − | 10 13 1 0 0 0 0 | + | 10 13 1 0 0 0 0 |
| − | 10 12 1 0 0 0 0 | + | 10 12 1 0 0 0 0 |
| − | 10 11 2 0 0 0 0 | + | 10 11 2 0 0 0 0 |
| − | 4 5 1 0 0 0 0 | + | 4 5 1 0 0 0 0 |
| − | 5 6 1 0 0 0 0 | + | 5 6 1 0 0 0 0 |
| − | 4 13 1 0 0 0 0 | + | 4 13 1 0 0 0 0 |
| − | S SKP 7 | + | S SKP 7 |
| − | ID BMFYB3OHe001 | + | ID BMFYB3OHe001 |
| − | NAME | + | NAME 2-Aminoethyl-2,3-dihydroxypropylhydrogen phosphate |
| − | FORMULA C5H14NO6P | + | CAS_RN 23919-24-6 |
| − | EXACTMASS 215.0558 | + | FORMULA C5H14NO6P |
| − | AVERAGEMASS 215.1415 | + | EXACTMASS 215.0558 |
| − | SMILES NCCOP(O)(=O)OC[C@H](O)CO | + | AVERAGEMASS 215.1415 |
| − | KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C01233 | + | SMILES NCCOP(O)(=O)OC[C@H](O)CO |
| + | KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C01233 | ||
M END | M END | ||
| − | |||
Latest revision as of 16:36, 16 June 2010
Copyright: ARM project http://www.metabolome.jp/
13 12 0 0 1 0 0 0 0 0999 V2000
5.4641 2.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 1.7500 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0
4.5981 1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -2.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -3.2500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
6.3301 3.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
6.3301 1.2500 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
3.7321 -0.2500 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0
3.2321 0.6160 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.2321 -1.1160 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -0.7500 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
1 7 1 0 0 0 0
2 8 1 1 0 0 0
3 9 1 0 0 0 0
9 10 1 0 0 0 0
10 13 1 0 0 0 0
10 12 1 0 0 0 0
10 11 2 0 0 0 0
4 5 1 0 0 0 0
5 6 1 0 0 0 0
4 13 1 0 0 0 0
S SKP 7
ID BMFYB3OHe001
NAME 2-Aminoethyl-2,3-dihydroxypropylhydrogen phosphate
CAS_RN 23919-24-6
FORMULA C5H14NO6P
EXACTMASS 215.0558
AVERAGEMASS 215.1415
SMILES NCCOP(O)(=O)OC[C@H](O)CO
KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C01233
M END
