Mol:BMMCPD--l001
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/
10 10 0 0 0 0 0 0 0 0999 V2000
2.8660 -0.0000 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0
3.7321 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 -0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7321 1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 -1.5000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.3301 0.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
5 4 2 0 0 0 0
5 6 1 0 0 0 0
6 1 2 0 0 0 0
1 2 1 0 0 0 0
2 3 2 0 0 0 0
3 4 1 0 0 0 0
3 7 1 0 0 0 0
7 8 1 0 0 0 0
7 10 2 0 0 0 0
1 9 1 0 0 0 0
S SKP 7
ID BMMCPD--l001
NAME 1-Methyl-nicotinamide
FORMULA C7H9N2O
EXACTMASS 137.0714
AVERAGEMASS 137.1592
SMILES C[n+1](c1)cc(cc1)C(N)=O
KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C02918
M END
