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2'-Deoxyadenosine-5,5-[d2] hydrate

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General Information
Catalog: BLP-008277
CAS: 478510-81-5
Molecular Formula: C10H11D2N5O3.H2O
Molecular Weight: 271.28

Chemical Structure

Description	2'-Deoxyadenosine-5,5-[d2] hydrate is the labelled analogue of 2'-Deoxyadenosine Monohydrate, which is used in the synthesis of 5'-modified 2'-deoxyadenosine analogues as an anti-hepatitis C virus agent.
Synonyms	2'-Deoxyadenosine hydrate (ribose-5,5-d2); 2'-Deoxyadenosine-5',5''-d2 Monohydrate; 2-Deoxyadenosine-ribose-5,5-d2 monohydrate; Adenine deoxyriboside-5,5-d2 hydrate; 2'-Deoxy-β-D-adenosine-5,5-d2 Monohydrate; 9-(2-Deoxy-β-D-erythro-pentofuranosyl)-9H-purin-6-amine-5,5-d2 Hydrate; 1-(6-Amino-9H-purin-9-yl)-1,2-dideoxy-β-D-ribofuranose-5,5-d2 Hydrate; 2-Deoxyadenine-9-β-D-erythro-pento-furanoside-5,5-d2 Hydrate
IUPAC Name	(2R,3S,5R)-5-(6-aminopurin-9-yl)-2-[dideuterio(hydroxy)methyl]oxolan-3-ol;hydrate
Related CAS	16373-93-6 (unlabelled) 958-09-8 (unlabelled anhydrous)
Canonical SMILES	C1C(C(OC1N2C=NC3=C(N=CN=C32)N)CO)O.O
InChI	InChI=1S/C10H13N5O3.H2O/c11-9-8-10(13-3-12-9)15(4-14-8)7-1-5(17)6(2-16)18-7;/h3-7,16-17H,1-2H2,(H2,11,12,13);1H2/t5-,6+,7+;/m0./s1/i2D2;
InChI Key	WZJWHIMNXWKNTO-SUJLILKXSA-N
Purity	98%; 98% atom D
Solubility	Slightly soluble in DMSO, Methanol
Appearance	White Solid
Storage	Store at 2-8°C