Alfacalcidol-d6

  • Deuterium
  • CAT Number: S000552
  • CAS Number: 1641940-94-4
  • Molecular Formula: C27H38D6O2
  • Molecular Weight: 406.67
  • Purity: ≥95%
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Alfacalcidol-d6 (Cat No.:S000552)is a specialized alfacalcidol, an active vitamin D used to treat hypocalcemia and metabolic bone diseases like osteoporosis. The “d6” designation indicates that six hydrogen atoms in the alfacalcidol molecule are replaced with deuterium, a stable isotope of hydrogen. This isotopic labeling enables precise tracking of alfacalcidol metabolism and its pharmacokinetics using advanced analytical techniques like mass spectrometry. Alfacalcidol-d6 is a valuable tool in pharmacological studies, elucidating drug metabolism, understanding its cellular effects, and investigating its efficacy and safety profiles in treating hypocalcemia and metabolic bone disorders.


Catalog Number S000552
CAS Number 1641940-94-4
Molecular Formula C27H38D6O2
Purity ≥95%
IUPAC Name (1R,3S,5Z)-5-[(2E)-2-[(1R,3aS,7aR)-7a-methyl-1-[(2R)-7,7,7-trideuterio-6-(trideuteriomethyl)heptan-2-yl]-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]ethylidene]-4-methylidenecyclohexane-1,3-diol
InChI InChI=1S/C27H44O2/c1-18(2)8-6-9-19(3)24-13-14-25-21(10-7-15-27(24,25)5)11-12-22-16-23(28)17-26(29)20(22)4/h11-12,18-19,23-26,28-29H,4,6-10,13-17H2,1-3,5H3/b21-11+,22-12-/t19-,23-,24-,25+,26+,27-/m1/s1/i1D3,2D3
InChIKey OFHCOWSQAMBJIW-VLUFQIGVSA-N
SMILES CC(C)CCCC(C)C1CCC2C1(CCCC2=CC=C3CC(CC(C3=C)O)O)C

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