RefMet Compound Details

MW structure37046 (View MW Metabolite Database details)
RefMet nameArgininosuccinic acid
Systematic name(2S)-2-{1-[(4S)-4-amino-4-carboxybutyl]carbamimidamido}butanedioic acid
SMILESN[C@@H](CCCNC(=N)N[C@@H](CC(O)=O)C(O)=O)C(O)=O
Exact mass290.122636 (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
FormulaC10H18N4O6View other entries in RefMet with this formula
InChIInChI=1S/C10H18N4O6/c11-5(8(17)18)2-1-3-13-10(12)14-6(9(19)20)4-7(15)16/h5-6H,1-4,11H2,(H,15,16)(H,17,18)(H,19,20)(H3,12,13,14)/t5
-,6-/m0/s1
InChIKeyKDZOASGQNOPSCU-WDSKDSINSA-NView other enantiomers/diastereomers of this metabolite in RefMet
Super ClassOrganic acids
Main ClassAmino acids and peptides
Sub ClassAmino acids
Pubchem CID16950
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 Argininosuccinic acid

Rxn IDKEGG ReactionEnzyme
R01086 N-(L-Arginino)succinate <=> Fumarate + L-Arginine2-(Nomega-L-arginino)succinate arginine-lyase (fumarate-forming)
R01954 ATP + L-Citrulline + L-Aspartate <=> AMP + Diphosphate + N-(L-Arginino)succinateL-Citrulline:L-aspartate ligase (AMP-forming)

Table of KEGG human pathways containing Argininosuccinic acid

Pathway IDHuman Pathway# of reactions
hsa00220 Arginine biosynthesis 2
hsa00250 Alanine, aspartate and glutamate metabolism 2
hsa01230 Biosynthesis of amino acids 2
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