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Chemical structure of Paricalcitol-D6

GC36854

Paricalcitol-D6

Also known as trans-(1R,3R)-5-[(2E)-2-[(1R,3aS,7aR)-7a-methyl-1-[(E,2R,5S)-7,7,7-trideuterio-6-hydroxy-5-methyl-6-(trideuteriomethyl)hept-3-en-2-yl]-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]ethylidene]cyclohexane-1,3-diol

Paricalcitol-d6 is the deuterium labeled Paricalcitol

ChemicalCAS2070009-67-3MW422.67FormulaC27H38D6O3
CAS number
2070009-67-3
Molecular weight
422.67
Formula
C27H38D6O3
Solubility
DMSO ： 100 mg/mL (236·59 mM; Need ultrasonic); DMSO ： 100 mg/mL (236·59 mM; Need ultrasonic)
InChIKey
BPKAHTKRCLCHEA-OYAGBYDGSA-N
Catalogue number
GC36854
Brand
GLPBIO
Computed properties PubChem CID 66577066 · XLogP 5 · TPSA 60.7 Ų · H-bond donors 3
XLogP
5
TPSA
60.7 Ų
H-bond donors
3
H-bond acceptors
3
Rotatable bonds
5
Heavy atoms
30

SMILES [2H]C([2H])([2H])C([C@@H](C)/C=C/[C@@H](C)[C@H]1CC[C@@H]\2[C@@]1(CCC/C2=C\C=C3C[C@H](C[C@@H](C3)O)O)C)(C([2H])([2H])[2H])O

Computed descriptors from PubChem (CID 66577066), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

Ordering in Israel

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