Mol:BMAXS3HOr001
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/
8 7 0 0 1 0 0 0 0 0999 V2000
3.7321 0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -0.0000 0.0000 C 0 0 3 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
3.3660 -0.8660 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
2.3660 0.8660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 -0.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.7321 1.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -1.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2 3 1 0 0 0 0
3 8 1 0 0 0 0
6 1 2 0 0 0 0
1 2 1 0 0 0 0
2 4 1 0 0 0 0
1 7 1 0 0 0 0
2 5 1 4 0 0 0
S SKP 7
ID BMAXS3HOr001
NAME (2R) -2-Amino-3-hydroxy-2-methylpropanoic acid
CAS_RN 5424-29-3
FORMULA C4H9NO3
EXACTMASS 119.0582
AVERAGEMASS 119.1192
SMILES OCC(C)(N)C(O)=O
KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C02115
M END
