CHEBI:62589 - 6-hydroxy-1H-purine-2,8(7H,9H)-dione

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ChEBI Name 6-hydroxy-1H-purine-2,8(7H,9H)-dione
ChEBI ID CHEBI:62589
ChEBI ASCII Name 6-hydroxy-1H-purine-2,8(7H,9H)-dione
Definition A tautomer of uric acid having oxo groups at C-2 and C-8 and a hydroxy group at C-6.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information eMolecules:31240396, eMolecules:516211, eMolecules:884300, ZINC000002041003
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Formula C5H4N4O3
Net Charge 0
Average Mass 168.110
Monoisotopic Mass 168.02834
InChI InChI=1S/C5H4N4O3/c10-3-1-2(7-4(11)6-1)8-5(12)9-3/h(H4,6,7,8,9,10,11,12)
InChIKey LEHOTFFKMJEONL-UHFFFAOYSA-N
SMILES C1=2NC(NC1=NC(=O)NC2O)=O
Roles Classification
Biological Role(s): human metabolite
Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
(via uric acid )
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ChEBI Ontology
Outgoing 6-hydroxy-1H-purine-2,8(7H,9H)-dione (CHEBI:62589) is a uric acid (CHEBI:27226)
6-hydroxy-1H-purine-2,8(7H,9H)-dione (CHEBI:62589) is conjugate acid of 6-hydroxy-2,8-dioxo-2,7,8,9-tetrahydropurin-1-ide (CHEBI:62585)
Incoming 6-hydroxy-2,8-dioxo-2,7,8,9-tetrahydropurin-1-ide (CHEBI:62585) is conjugate base of 6-hydroxy-1H-purine-2,8(7H,9H)-dione (CHEBI:62589)
IUPAC Name
6-hydroxy-1H-purine-2,8(7H,9H)-dione
Manual Xref Database
URC PDBeChem
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Last Modified
25 November 2019