Ribavirin-[13C5]

Category	SARS-CoV
CAS	1646818-35-0
Description	Ribavirin-[13C5] is the labelled analogue of Ribavirin. Ribavirin is an anti-viral medication used to treat RSV infection, hepatitis C, and viral hemorrhagic fever.

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Synonyms	[13C5]-Ribavirin; 1-β-D-Ribofuranosyl-1H-1,2,4-triazole-3-carboxamide-13C5; Copegus-13C5; ICN 1229-13C5; MegaRibavirin-13C5; NSC 163039-13C5; Ravanex-13C5; Rebetol-13C5; Ribamide-13C5; Ribamidil-13C5; Ribasphere-13C5; Ribavarin-13C5; Tribavirin-13C5; Vilona-13C5; Viramid-13C5; Virazole-13C5; Virizadole-13C5
IUPAC Name	1-[(2R,4R,5R)-3,4-dihydroxy-5-(hydroxy(1-13C)methyl)(2,3,4,5-13C4)oxolan-2-yl]-1,2,4-triazole-3-carboxamide
Molecular Weight	249.17
Molecular Formula	C3[13C]5H12N4O5
Canonical SMILES	C1=NC(=NN1C2C(C(C(O2)CO)O)O)C(=O)N
InChI	InChI=1S/C8H12N4O5/c9-6(16)7-10-2-12(11-7)8-5(15)4(14)3(1-13)17-8/h2-5,8,13-15H,1H2,(H2,9,16)/t3-,4+,5?,8-/m1/s1/i1+1,3+1,4+1,5+1,8+1
InChIKey	IWUCXVSUMQZMFG-GOZXRHHJSA-N
Melting Point	160-162°C
Purity	95%; > 98% atom 13C
Solubility	Slightly soluble in DMSO, Methanol, Water
Appearance	Off-White to Pale Yellow Solid
Storage	-20 °C under inert atmosphere
Complexity	304
Exact Mass	249.09754367
In Vitro	Stable heavy isotopes of hydrogen, carbon, and other elements have been incorporated into drug molecules, largely as tracers for quantitation during the drug development process. Deuteration has gained attention because of its potential to affect the pharmacokinetic and Metabolic profiles of drugs.
Target	HCV; RSV; Antibiotic
XLogP3-AA	-1.8