Mol:BMMCIZ--k003
From Metabolomics.JP
(Difference between revisions)
| Line 27: | Line 27: | ||
S SKP 7 | S SKP 7 | ||
ID BMMCIZ--k003 | ID BMMCIZ--k003 | ||
| − | NAME ( | + | NAME (2S) -2-Hydroxy-3- (1H-imidazol-5-yl) propanoic acid |
| + | CAS_RN 14403-45-3 | ||
FORMULA C6H8N2O3 | FORMULA C6H8N2O3 | ||
EXACTMASS 156.0534 | EXACTMASS 156.0534 | ||
Latest revision as of 17:49, 17 June 2010
Copyright: ARM project http://www.metabolome.jp/
11 11 0 0 1 0 0 0 0 0999 V2000
2.9945 1.0694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.5823 0.2604 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0
4.5768 0.3649 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.8556 -1.3952 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
5.6646 -1.9829 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.4736 -1.3952 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
6.1646 -0.4441 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.1646 -0.4441 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.1756 -0.6532 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 0.9649 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.4013 1.9829 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3 2 1 0 0 0 0
1 11 1 0 0 0 0
1 10 2 0 0 0 0
2 1 1 0 0 0 0
2 9 1 1 0 0 0
8 7 2 0 0 0 0
6 5 2 0 0 0 0
5 4 1 0 0 0 0
4 8 1 0 0 0 0
7 6 1 0 0 0 0
8 3 1 0 0 0 0
S SKP 7
ID BMMCIZ--k003
NAME (2S) -2-Hydroxy-3- (1H-imidazol-5-yl) propanoic acid
CAS_RN 14403-45-3
FORMULA C6H8N2O3
EXACTMASS 156.0534
AVERAGEMASS 156.1394
SMILES OC(=O)[C@H](O)Cc(c1)ncn1
KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C03817
M END
