Mol:BMCCPPPY0005
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/
8 8 0 0 0 0 0 0 0 0999 V2000
2.8090 -0.4197 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
3.6180 0.1681 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.3090 1.1191 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3090 1.1191 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 0.1681 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5691 -0.1410 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.7770 -1.1191 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
5.3122 0.5282 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1 2 1 0 0 0 0
2 3 2 0 0 0 0
4 3 1 0 0 0 0
2 6 1 0 0 0 0
4 5 2 0 0 0 0
6 7 2 0 0 0 0
5 1 1 0 0 0 0
6 8 1 0 0 0 0
S SKP 7
ID BMCCPPPY0005
NAME Pyrrole-2-carboxylic acid
FORMULA C5H5NO2
EXACTMASS 111.032
AVERAGEMASS 111.0987
SMILES OC(=O)c(c1)ncc1
KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C05942
M END
