Ritonavir-13C3
Product Code
TRC-R535003
CAS Number
Product Format
Neat
Molecular Formula
13C3 C34 H48 N6 O5 S2
Molecular Weight
723.92
API Family
RitonavirProduct Categories
TRC, Enzyme inhibitors, Metabolites & bioactive compounds, Enzyme inhibitors, Metabolites & bioactive compounds, API Reference Standards & Research Materials, Anti-HIV agents, Antivirals and antiretrovirals, Stable isotopes, Stable Isotope Labelled Analytical Standards, Pharmaceutical Toxicology Reference Materials
Unlabelled CAS Number
Purity
>95% (HPLC)
Documentation
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Product Information
Chemical Data
Analyte Name
Ritonavir 4,5,methyl-methylthiazolyl-13C3
CAS Number
1217673-23-8
Molecular Formula
13C3 C34 H48 N6 O5 S2
Molecular Weight
723.92
Accurate Mass
723.3228
SMILES
CC(C)[C@H](NC(=O)N(C)Cc1csc(n1)C(C)C)C(=O)N[C@H](C[C@H](O)[C@H](Cc2ccccc2)NC(=O)O[13CH2][13c]3[13cH]ncs3)Cc4ccccc4
InChI
InChI=1S/C37H48N6O5S2/c1-24(2)33(42-36(46)43(5)20-29-22-49-35(40-29)25(3)4)34(45)39-28(16-26-12-8-6-9-13-26)18-32(44)31(17-27-14-10-7-11-15-27)41-37(47)48-21-30-19-38-23-50-30/h6-15,19,22-25,28,31-33,44H,16-18,20-21H2,1-5H3,(H,39,45)(H,41,47)(H,42,46)/t28-,31-,32-,33-/m0/s1/i19+1,21+1,30+1
IUPAC
(4,5-^{13}C_{2})thiazol-5-yl(1^{13}C)methyl N-[(1S,2S,4S)-1-benzyl-2-hydroxy-4-[[(2S)-2-[[(2-isopropylthiazol-4-yl)methyl-methyl-carbamoyl]amino]-3-methyl-butanoyl]amino]-5-phenyl-pentyl]carbamate
Unlabelled CAS Number
155213-67-5
SIL Type
Carbon
Product Data
Storage Temperature
-20°C
Shipping Temperature
Room Temperature
Country of Origin
CANADA
Product Type
API; Stable Isotope Labelled
Product Format
Neat
API Family
Purity
>95% (HPLC)
Product Description
A stable labelled selective HIV protease inhibitor Ritonavir (R535000). It is a COVID19-related research product.
References: Daluge, S., et al.: Antimicrob. Agents Chemother., 38, 1590 (1994), Ammaranond, P., et al.: J. Clin. Virol., 26, 153(2003), Harrigan, P., et al.: J. Infect. Dis., 191, 339 (2005), Miller, J., et al.: Bioorg. Med. Chem. Lett., 16, 1788 (2006)
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