Mol:BMAAS3PH0003
From Metabolomics.JP
(Difference between revisions)
| Line 25: | Line 25: | ||
ID BMAAS3PH0003 | ID BMAAS3PH0003 | ||
NAME Phosphono-alanine | NAME Phosphono-alanine | ||
| − | CAS_RN 5652-28-8 | + | CAS_RN 5652-28-8 |
FORMULA C3H8NO5P | FORMULA C3H8NO5P | ||
EXACTMASS 169.014 | EXACTMASS 169.014 | ||
Revision as of 14:23, 11 June 2010
Copyright: ARM project http://www.metabolome.jp/
10 9 0 0 1 0 0 0 0 0999 V2000
4.5981 0.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7321 0.4330 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0
3.7321 -0.5670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 0.9330 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -1.0670 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0
2.3660 -0.2010 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.3660 -1.9330 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -1.5670 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 0.4330 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 1.9330 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3 2 1 0 0 0 0
5 7 1 0 0 0 0
2 4 1 4 0 0 0
5 6 2 0 0 0 0
2 1 1 0 0 0 0
5 8 1 0 0 0 0
3 5 1 0 0 0 0
1 9 1 0 0 0 0
1 10 2 0 0 0 0
S SKP 7
ID BMAAS3PH0003
NAME Phosphono-alanine
CAS_RN 5652-28-8
FORMULA C3H8NO5P
EXACTMASS 169.014
AVERAGEMASS 169.0731
SMILES NC(C(O)=O)CP(O)(O)=O
KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C05672
M END
