Mol:BMAAS4SF0002
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/
8 7 0 0 1 0 0 0 0 0999 V2000
3.7321 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 0.5000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0
2.8660 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 1.0000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -2.0000 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 0.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.7321 2.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2 5 1 6 0 0 0
1 7 1 0 0 0 0
1 8 2 0 0 0 0
2 1 1 0 0 0 0
2 3 1 0 0 0 0
3 4 1 0 0 0 0
4 6 1 0 0 0 0
S SKP 7
ID BMAAS4SF0002
NAME L-Homocysteine
FORMULA C4H9NO2S
EXACTMASS 135.0353
AVERAGEMASS 135.1858
SMILES N[C@@H](CCS)C(O)=O
KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C00155
M END
