Mol:BMMCBZ3Sk033
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/
12 12 0 0 0 0 0 0 0 0999 V2000
5.4641 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7321 -0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7321 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.3301 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 -1.5000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -0.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
6.3301 -1.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
7.1962 0.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
6 5 1 0 0 0 0
3 10 1 0 0 0 0
2 8 1 0 0 0 0
5 4 2 0 0 0 0
10 9 1 0 0 0 0
4 3 1 0 0 0 0
1 7 1 0 0 0 0
3 2 2 0 0 0 0
7 11 1 0 0 0 0
2 1 1 0 0 0 0
1 6 2 0 0 0 0
12 7 2 0 0 0 0
S SKP 7
ID BMMCBZ3Sk033
NAME 3-Methoxy-anthranilic acid
FORMULA C8H9NO3
EXACTMASS 167.0582
AVERAGEMASS 167.162
SMILES COc(c1)c(N)c(cc1)C(O)=O
KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C05831
M END
