Mol:BMAXDP--0014
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/
11 10 0 0 1 0 0 0 0 0999 V2000
4.5981 1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7321 1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7321 0.2500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -1.2500 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0
2.0000 -1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7321 -1.7500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -2.7500 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 1.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 2.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 0.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3 2 1 0 0 0 0
2 1 1 0 0 0 0
1 9 2 0 0 0 0
1 10 1 0 0 0 0
5 7 1 1 0 0 0
5 4 1 0 0 0 0
4 11 2 0 0 0 0
6 8 1 0 0 0 0
5 6 1 0 0 0 0
4 3 1 0 0 0 0
S SKP 7
ID BMAXDP--0014
NAME L-Cysteinyl-glycine
FORMULA C5H10N2O3S
EXACTMASS 178.0412
AVERAGEMASS 178.2105
SMILES N[C@@H](CS)C(=O)NCC(O)=O
KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C01419
M END
