Mol:BMMCBZ2Mk007
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/
11 11 0 0 0 0 0 0 0 0999 V2000
3.7321 -0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -0.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7321 -2.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 -1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 -0.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7321 0.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 0.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 2.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -2.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1 2 1 0 0 0 0
1 6 2 0 0 0 0
1 7 1 0 0 0 0
2 3 2 0 0 0 0
6 5 1 0 0 0 0
7 8 1 0 0 0 0
3 4 1 0 0 0 0
3 11 1 0 0 0 0
8 9 1 0 0 0 0
8 10 2 0 0 0 0
5 4 2 0 0 0 0
S SKP 7
ID BMMCBZ2Mk007
NAME 3-Hydroxy-phenyl-acetic acid
FORMULA C8H8O3
EXACTMASS 152.0473
AVERAGEMASS 152.1473
SMILES OC(=O)Cc(c1)cc(O)cc1
KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C05593
M END
