RefMet Compound Details

MW structure37058 (View MW Metabolite Database details)
RefMet nameDeoxyinosine
Systematic name9-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-9H-purin-6-ol
SMILESC1[C@@H]([C@@H](CO)O[C@H]1n1cnc2c1nc[nH]c2=O)O   Run Tanimoto similarity search (with similarity coefficient >=0.6)
Exact mass252.085856 (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
FormulaC10H12N4O4View other entries in RefMet with this formula
InChIKeyVGONTNSXDCQUGY-RRKCRQDMSA-NView other enantiomers/diastereomers of this metabolite in RefMet
Super ClassNucleic acids
Main ClassPurines
Sub ClassPurine deoxyribonucleosides
Pubchem CID135398593
Annotation level1   (1:Known structure; 2:Known regiochemistry; 3:Partial structure; 4:Sum-composition)

Table of KEGG reactions in human pathways involving Deoxyinosine

Rxn IDKEGG ReactionEnzyme
R02748 Deoxyinosine + Orthophosphate <=> Hypoxanthine + 2-Deoxy-D-ribose 1-phosphateDeoxyinosine:orthophosphate ribosyltransferase
R12958 2'-Deoxyinosine 5'-phosphate + H2O <=> Deoxyinosine + OrthophosphatedIMP phosphohydrolase
R02556 Deoxyadenosine + H2O <=> Deoxyinosine + AmmoniaDeoxyadenosine aminohydrolase

Table of KEGG human pathways containing Deoxyinosine

Pathway IDHuman Pathway# of reactions
hsa00230 Purine metabolism 2
hsa01232 Nucleotide metabolism 1