2-Chloropropane-1,3-diyl distearate-d5

For research use only. Not for therapeutic Use.

  • CAT Number: R050096
  • CAS Number: 1329796-49-7
  • Molecular Formula: C39H70D5ClO4
  • Molecular Weight: 648.49
  • Purity: ≥95%
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2-Chloropropane-1,3-diyl distearate-d5 is a deuterium labeled compound.
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[1].


Catalog Number R050096
CAS Number 1329796-49-7
Synonyms

(2-chloro-1,1,2,3,3-pentadeuterio-3-octadecanoyloxypropyl) octadecanoate

Molecular Formula C39H70D5ClO4
Purity ≥95%
InChI InChI=1S/C39H75ClO4/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-38(41)43-35-37(40)36-44-39(42)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h37H,3-36H2,1-2H3/i35D2,36D2,37D
InChIKey PYMWUYDMRZYIBN-RYBIQIASSA-N
SMILES CCCCCCCCCCCCCCCCCC(=O)OCC(COC(=O)CCCCCCCCCCCCCCCCC)Cl
Reference

[1]. Russak EM, et al. Impact of Deuterium Substitution on the Pharmacokinetics of Pharmaceuticals. Ann Pharmacother. 2019 Feb;53(2):211-246.
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