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CAS 261506-45-0

:

6H-Purin-6-one, 2-amino-1,9-dihydro-9-[(2-hydroxyethoxy)methyl]-, sodium salt, hydrate (1:1:2)

Description:
6H-Purin-6-one, 2-amino-1,9-dihydro-9-[(2-hydroxyethoxy)methyl]-, sodium salt, hydrate (1:1:2), commonly referred to as a sodium salt of a purine derivative, exhibits several notable characteristics. This compound is a purine analog, which means it shares structural similarities with naturally occurring purines like adenine and guanine. It typically appears as a white to off-white solid and is soluble in water due to the presence of the sodium salt and hydroxyl groups, which enhance its hydrophilicity. The compound's structure includes a purine ring system, an amino group, and a hydroxyethoxy side chain, contributing to its potential biological activity. It may be involved in various biochemical pathways, particularly in nucleic acid metabolism or as a pharmaceutical agent. The hydrate form indicates the presence of water molecules in its crystalline structure, which can influence its stability and solubility. Overall, this compound's unique structure and properties make it of interest in medicinal chemistry and biochemistry.
Formula:C8H11N5O3·2H2O·Na
InChI:InChI=1S/C8H11N5O3.Na.2H2O/c9-8-11-6-5(7(15)12-8)10-3-13(6)4-16-2-1-14;;;/h3,14H,1-2,4H2,(H3,9,11,12,15);;2*1H2
InChI key:InChIKey=ZZAKCPCKVRWWCF-UHFFFAOYSA-N
SMILES:C(OCCO)N1C2=C(N=C1)C(=O)N=C(N)N2.[Na].O
Synonyms:
  • 6H-Purin-6-one, 2-amino-1,9-dihydro-9-[(2-hydroxyethoxy)methyl]-, sodium salt, hydrate (1:1:2)
  • 6H-Purin-6-one, 2-amino-1,9-dihydro-9-[(2-hydroxyethoxy)methyl]-, monosodium salt, dihydrate
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