9H-purine

GPTKB entity

Statements (33)
Predicate Object
gptkbp:instanceOf gptkb:chemical_compound
heterocyclic aromatic organic compound
gptkbp:appearance white solid
gptkbp:CASNumber 120-73-0
gptkbp:chemicalFormula C5H4N4
gptkbp:density 1.477 g/cm³
gptkbp:discoveredBy gptkb:Emil_Fischer
gptkbp:discoveredIn 1884
gptkbp:foundIn nucleic acids
gptkbp:hasInChIKey InChI=1S/C5H4N4/c1-3-7-5-4(6-1)8-2-1/h1-4H
gptkbp:hasSMILES c1ncnc2n1ccc2
https://www.w3.org/2000/01/rdf-schema#label 9H-purine
gptkbp:IUPACName purine
gptkbp:KEGGID C00294
gptkbp:meltingPoint 214–216 °C
gptkbp:molecularWeight 120.11 g/mol
gptkbp:parent gptkb:hypoxanthine
gptkb:xanthine
adenine
guanine
uric acid
gptkbp:pKa 8.93
gptkbp:PubChem_CID gptkb:CHEMBL123
1044
CHEBI:18186
gptkbp:relatedTo pyrimidine
gptkbp:solubility slightly soluble
gptkbp:structure fused pyrimidine and imidazole rings
gptkbp:systematicName gptkb:9H-purine
gptkbp:UNII 3KX376GY7L
gptkbp:used_in biochemistry
gptkbp:bfsParent gptkb:Purine
gptkbp:bfsLayer 6