Mol:BMMCIZ--k009
From Metabolomics.JP
(Difference between revisions)
| Line 25: | Line 25: | ||
S SKP 7 | S SKP 7 | ||
ID BMMCIZ--k009 | ID BMMCIZ--k009 | ||
| − | NAME 4- | + | NAME 3- (5-Oxo-1,4-dihydroimidazol-4-yl) propanoic acid |
| + | CAS_RN 98021-23-9 | ||
FORMULA C5H6N2O3 | FORMULA C5H6N2O3 | ||
EXACTMASS 142.0378 | EXACTMASS 142.0378 | ||
Revision as of 17:50, 17 June 2010
Copyright: ARM project http://www.metabolome.jp/
10 10 0 0 1 0 0 0 0 0999 V2000
2.8090 -0.4897 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 0.0981 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3090 1.0492 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
3.3090 1.0492 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.6180 0.0981 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0
4.5691 -0.2109 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.7770 -1.1891 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.8968 1.8582 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.0339 -1.8582 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
5.7281 -1.4981 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3 2 2 0 0 0 0
5 1 1 4 0 0 0
5 4 1 0 0 0 0
4 3 1 0 0 0 0
2 1 1 0 0 0 0
4 8 2 0 0 0 0
5 6 1 0 0 0 0
7 9 1 0 0 0 0
7 10 2 0 0 0 0
6 7 1 0 0 0 0
S SKP 7
ID BMMCIZ--k009
NAME 3- (5-Oxo-1,4-dihydroimidazol-4-yl) propanoic acid
CAS_RN 98021-23-9
FORMULA C5H6N2O3
EXACTMASS 142.0378
AVERAGEMASS 142.1128
SMILES OC(=O)CC(N1)C(=O)N=C1
KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C05133
M END
