RefMet Compound Details

RefMet ID	RM0012560
MW structure	37346 (View MW Metabolite Database details)
RefMet name	Glutamine
Systematic name	(2S)-2-amino-4-carbamoylbutanoic acid
SMILES	C(CC(=O)N)[C@@H](C(=O)O)N   Run Tanimoto similarity search (with similarity coefficient >=0.6)
Exact mass	146.069143 (neutral)	Calculate m/z: (Choose adduct) [M+H]+ [M+H-H2O]+ [M.]+ [M+2H]2+ [M+3H]3+ [M+4H]4+ [M+K]+ [M+2K]2+ [M+2K-H]+ [M+Na]+ [M+2Na]2+ [M+2Na-H]+ [M+Li]+ [M+2Li]2+ [M+NH4]+ [M.CH3]+ [M+Ag]+ [M+H+CH3OH]+ [M+H+CH3CN]+ [M+H+2CH3CN]+ [M+Na+CH3CN]+ [M.NaFormate+H]+ [M.NH4Formate+H]+ [M.TMSi]+ [M.tBuDMSi]+ [M+H-Hexose]+ [M+H-EtnP]+ [M+H-SerP]+ [M-H]- [M-H-H2O]- [M-CH3]- [M-2H]2- [M-3H]3- [M-4H]4- [M+Cl]- [M+OAc]- [M+Na-2H]- [M+K-2H]- [M.Formate]- [M.NaFormate-H]- [M.NH4Formate-H]- [M.F]- [M-H-Ser]- [M.HF2]- M(neutral)    View other RefMet entries with this exact (neutral) mass:   +/- 0.05 amu   +/- 0.1 amu   +/- 0.2 amu   +/- 0.5 amu
Formula	C5H10N2O3	View other entries in RefMet with this formula
InChI	InChI=1S/C5H10N2O3/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H2,7,8)(H,9,10)/t3-/m0/s1
InChIKey	ZDXPYRJPNDTMRX-VKHMYHEASA-N	View other enantiomers/diastereomers of this metabolite in RefMet
Super Class	Organic acids
Main Class	Amino acids and peptides
Sub Class	Amino acids
Pubchem CID	5961
ChEBI ID	18050
Annotation level	1   (1:Known structure; 2:Known regiochemistry; 3:Partial structure; 4:Sum-composition)

Table of KEGG reactions in human pathways involving Glutamine

Rxn ID	KEGG Reaction	Enzyme
R00253	ATP + L-Glutamate + Ammonia <=> ADP + Orthophosphate + L-Glutamine	L-Glutamate:ammonia ligase (ADP-forming)
R00256	L-Glutamine + H2O <=> L-Glutamate + Ammonia	L-glutamine amidohydrolase
R00575	2 ATP + L-Glutamine + HCO3- + H2O <=> 2 ADP + Orthophosphate + L-Glutamate + Carbamoyl phosphate	HCO3-:L-glutamine amido-ligase (ADP-forming, carbamate-phosphorylating)
R00768	L-Glutamine + D-Fructose 6-phosphate <=> L-Glutamate + D-Glucosamine 6-phosphate	L-glutamine:D-fructose-6-phosphate isomerase (deaminating)
R01072	5-Phosphoribosylamine + Diphosphate + L-Glutamate <=> L-Glutamine + 5-Phospho-alpha-D-ribose 1-diphosphate + H2O	5-phosphoribosylamine:diphosphate phospho-alpha-D-ribosyltransferase (glutamate-amidating)
R03652	ATP + L-Glutamine + tRNA(Gln) <=> AMP + Diphosphate + Glutaminyl-tRNA	L-Glutamine:tRNA(Gln) ligase (AMP-forming)

Table of KEGG human pathways containing Glutamine

Pathway ID	Human Pathway	# of reactions
hsa00250	Alanine, aspartate and glutamate metabolism	4
hsa00220	Arginine biosynthesis	2
hsa00240	Pyrimidine metabolism	1
hsa00471	D-Glutamine and D-glutamate metabolism	1
hsa00630	Glyoxylate and dicarboxylate metabolism	1
hsa00910	Nitrogen metabolism	1
hsa00970	Aminoacyl-tRNA biosynthesis	1
hsa01230	Biosynthesis of amino acids	1
hsa00230	Purine metabolism	1