Paricalcitol

CAT: 0013-GTR19164533-01Size: 1 mgDry Ice: NoHazardous: No

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CAT#:0013-GTR19164533-01Size:1 mg

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Description

Paricalcitol is a selective vitamin D receptor agonist used to manage secondary hyperparathyroidism in chronic kidney disease. It is widely employed in renal research, with studies demonstrating its effects on parathyroid hormone suppression in both in vitro cell models and in vivo animal studies of renal failure.

CAS Number

131918-61-1

Product Name Alternative

Inhibitor, Paricalcitol, inhibit, VD/VDR, Vitamin D receptor, vitamin D receptor, Vitamin D

Field of Research

Metabolism Research, Pharmacology & Drug Discovery

Purity

98.59% (May vary between batches)

Solubility

Ethanol:12 mg/mL (28.8 mM) ;10% DMSO+90% Corn Oil:3.3 mg/mL (7.92 mM) ; H2O:Insoluble; DMSO:140 mg/mL (336.02 mM)

Smiles

[H][C@@]12CC[C@H] ([C@H] (C) \C=C\[C@H] (C) C (C) (C) O) [C@@]1 (C) CCC\C2=C/C=C1C[C@@H] (O) C[C@H] (O) C1

Molecular Formula

C27H44O3

Molecular Weight

416.64

Storage Conditions

Powder: -20°C for 3 years | Shipping with blue ice/Shipping at ambient temperature.

Notes

For research use only.

Chemical Information

Paricalcitol

Paricalcitol is a seco-cholestane and a hydroxy seco-steroid. It has a role as an antiparathyroid drug. It is functionally related to a vitamin D2.

CAS Number	131918-61-1
PubChem CID	5281104
IUPAC Name	trans-(1R,3R)-5-[(2E)-2-[(1R,3aS,7aR)-1-[(E,2R,5S)-6-hydroxy-5,6-dimethylhept-3-en-2-yl]-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]ethylidene]cyclohexane-1,3-diol
Molecular Formula	C27H44O3
Molecular Weight	416.6
XLogP	5
Topological Polar Surface Area	60.7
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	5
Heavy Atom Count	30
Formal Charge	0
Complexity	676

SMILES

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

InChI

InChI=1S/C27H44O3/c1-18(8-9-19(2)26(3,4)30)24-12-13-25-21(7-6-14-27(24,25)5)11-10-20-15-22(28)17-23(29)16-20/h8-11,18-19,22-25,28-30H,6-7,12-17H2,1-5H3/b9-8+,21-11+/t18-,19+,22-,23-,24-,25+,27-/m1/s1

InChIKey

BPKAHTKRCLCHEA-UBFJEZKGSA-N

Chemical Structure

2D Structure

CAS: 131918-61-1

CID: 5281104

Formula: C27H44O3

MW: 416.6

Interactive 3D Structure

Loading 3D structure...

View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	416.6
XLogP3	5
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	5
Exact Mass	416.32904526
Monoisotopic Mass	416.32904526
Topological Polar Surface Area	60.7 Å²
Heavy Atom Count	30
Formal Charge	0
Complexity	676
Isotope Atom Count	0
Defined Atom Stereocenter Count	7
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	2
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Alternative Products

Catalog	Name
A3702-1	Paricalcitol
CS-O-06853	Paricalcitol-d6
HY-50919R	Paricalcitol (Standard)

Paricalcitol

Chemical Information

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