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6-Methylmercaptopurine-[d3]

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General Information
Catalog: BLP-013002
CAS: 33312-93-5
Molecular Formula: C6H3D3N4S
Molecular Weight: 169.22

Chemical Structure

Description	6-Methylmercaptopurine-[d3] is the labelled analogue of 6-Methylmercaptopurine, which is a metabolite of 6-Mercaptopurine, an immunosuppressive drug used to treat leukemia.
Synonyms	6-Methylmercaptopurine-d3; 6-(Methylthio)-9H-purine-d3; 6-(Methylthio)purine-d3; NSC 20105-d3; S-Methyl-6-mercaptopurine-d3; SQ 8343-d3
IUPAC Name	6-(trideuteriomethylsulfanyl)-7H-purine
Related CAS	50-66-8 (unlabelled)
Isomeric SMILES	[2H]C([2H])([2H])SC1=NC=NC2=C1NC=N2
Canonical SMILES	CSC1=NC=NC2=C1NC=N2
InChI	InChI=1S/C6H6N4S/c1-11-6-4-5(8-2-7-4)9-3-10-6/h2-3H,1H3,(H,7,8,9,10)/i1D3
InChI Key	UIJIQXGRFSPYQW-FIBGUPNXSA-N
Melting Point	>215°C
Purity	98%; 99.8% atom D
Solubility	Soluble in DMSO (Slightly), Methanol (Slightly)
Appearance	White to Off-white Solid
Storage	Store at 2-8°C