Mol:BMMCIZ--k020
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/
9 9 0 0 0 0 0 0 0 0999 V2000
5.4190 1.4537 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
5.7281 0.5026 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.9190 -0.0852 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
4.1100 0.5026 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.4190 1.4537 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.1590 0.1936 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.9511 -0.7845 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.6942 -1.4537 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -1.0936 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1 5 1 0 0 0 0
4 3 1 0 0 0 0
4 6 1 0 0 0 0
5 4 2 0 0 0 0
6 7 1 0 0 0 0
3 2 2 0 0 0 0
2 1 1 0 0 0 0
7 8 1 0 0 0 0
7 9 2 0 0 0 0
S SKP 7
ID BMMCIZ--k020
NAME Imidazole-4-acetic acid
FORMULA C5H6N2O2
EXACTMASS 126.0429
AVERAGEMASS 126.1134
SMILES OC(=O)Cc(c1)ncn1
KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C02835
M END
