RefMet Compound Details

MW structure37113 (View MW Metabolite Database details)
RefMet nameThreonine
Systematic name(2S,3R)-2-amino-3-hydroxybutanoic acid
SMILESC[C@@H](O)[C@H](N)C(O)=O
Exact mass119.058244 (neutral)
Calculate m/z:   
View other RefMet entries with this exact (neutral) mass:   +/- 0.05 amu   +/- 0.1 amu   +/- 0.2 amu   +/- 0.5 amu
FormulaC4H9NO3View other entries in RefMet with this formula
InChIInChI=1S/C4H9NO3/c1-2(6)3(5)4(7)8/h2-3,6H,5H2,1H3,(H,7,8)/t2-,3+/m1/s1
InChIKeyAYFVYJQAPQTCCC-GBXIJSLDSA-NView other enantiomers/diastereomers of this metabolite in RefMet
Super ClassOrganic acids
Main ClassAmino acids and peptides
Sub ClassAmino acids
Pubchem CID6288
Annotation level1   (1:Known structure; 2:Known regiochemistry; 3:Partial structure; 4:Sum-composition)
Human quantitationView measurements in targeted assays on human samples

Table of KEGG reactions in human pathways involving Threonine

Rxn IDKEGG ReactionEnzyme
R00996 L-Threonine <=> 2-Oxobutanoate + AmmoniaL-threonine ammonia-lyase (2-oxobutanoate-forming)

Table of KEGG human pathways containing Threonine

Pathway IDHuman Pathway# of reactions
hsa00260 Glycine, serine and threonine metabolism 1
hsa00290 Valine, leucine and isoleucine biosynthesis 1
hsa01230 Biosynthesis of amino acids 1
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