Mol:BMFYB5CAr002
From Metabolomics.JP
Copyright: ARM project http://www.metabolome.jp/
10 9 0 0 1 0 0 0 0 0999 V2000
2.8660 -1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -0.2500 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0
3.7321 0.2500 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0
4.5981 0.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.2321 -0.6160 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7321 -1.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -1.7500 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
3.2321 1.1160 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3 2 1 0 0 0 0
1 8 2 0 0 0 0
4 3 1 0 0 0 0
4 5 1 0 0 0 0
2 1 1 0 0 0 0
2 9 1 4 0 0 0
3 10 1 1 0 0 0
1 7 1 0 0 0 0
3 6 1 6 0 0 0
S SKP 7
ID BMFYB5CAr002
NAME (2R,3R) -2,3-Dihydroxy-3-methylpentanoic acid
CAS_RN 37504-87-3
FORMULA C6H12O4
EXACTMASS 148.0735
AVERAGEMASS 148.157
SMILES CC[C@](C)(O)C(O)C(O)=O
KEGG http://www.genome.jp/dbget-bin/www_bget?compound+C06007
M END
