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19356-17-3 (Calcifediol)

1

Identification

Calcifediol Calcifediol
Name Calcifediol
Formula C27H44O2
MW 400.64
CAS No. 19356-17-3
EINECS 242-990-9
Smiles C[[email protected]](CCCC(C)(O)C)[[email protected]@H]1[[email protected]](CCC/2)(C)[[email protected]](CC1)([H])C2=CC=C(C[[email protected]]3O)/C(CC3)=C
Synonyms (S,Z)-3-((E)-2-((1R,3aS,7aR)-1-((R)-6-hydroxy-6-methylheptan-2-yl)-7a-methylhexahydro-1H-inden-4(2H)-ylidene)ethylidene)-4-methylenecyclohexanol
InChI InChI=1S/C27H44O2/c1-19-10-13-23(28)18-22(19)12-11-21-9-7-17-27(5)24(14-15-25(21)27)20(2)8-6-16-26(3,4)29/h11-12,20,23-25,28-29H,1,6-10,13-18H2,2-5H3/b21-11+,22-12-/t20-,23+,24-,25+,27-/m1/s1
2

Introduction

Calcifediol(25-hydroxy Vitamin D3) is a prehormone that is produced in the liver by hydroxylation of vitamin D3 (cholecalciferol) by the enzyme cholecalciferol 25-hydroxylase IC50 value: Target: This metabolite is being measured by physicians worldwide to determine a patient's vitamin d status.Calcifediol is then converted in the kidneys (by the enzyme 25(OH)D-1α-hydroxylase) into calcitriol (1,25-(OH)2D3), a secosteroid hormone that is the active form of vitamin D.

Background Information

One of the metabolite of Vitamin D3, which has been found to be effective in mediating intestinal calcium absorbtion and bone calcium metabolism. ......by BOC Sciences
Calcifediol is a major circulating metabolite of vitamin D3, acting as a competitive inhibitor with an apparent Ki of 3.9 μM, suppresses PTH secretion and mRNA (ED50=2 nM). ......by MedChemexpress Co., Ltd.
Calcifediol is a major circulating metabolite of vitamin D3 and acts as a competitive inhibitor with an apparent Ki of 3.9 μM. It also suppresses PTH secretion and mRNA (ED50=2 nM). ......by Selleck Chemicals LLC
Calcifediol is a major circulating metabolite of vitamin D3 and acts as a competitive inhibitor with an apparent Ki of 3.9 μM. It also suppresses PTH secretion and mRNA (ED50=2 nM). ......by Target Molecule Corp.
3

Protocol(Only for Reference)

Cell Experiment

Animal Experiment

4

Physical and Chemical Properties

Appearance: EBNumber:EB000025817

Storage condition

Solubility

Chloroform, Methanol by MedChemexpress Co., Ltd.
(25°C) * In vitro DMSO 80 mg/mL (199.68 mM); Ethanol20 mg/mL (49.92 mM); Water<1 mg/mL (<1 mM); In vivo 2% DMSO+30% PEG 300+5% Tween+ddH2O5mg/mL by Selleck Chemicals LLC
5

Mechanism and Indication

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Clinical Information

Product Name Sponsor & Collaborators Indications Start Date End Date Phase
Calcifediol Montefiore Medical Center Vitamin D deficiency 2013/1/31 2014/7/31 Phase 4 Clinical
Calcifediol Seoul National University Hospital End stage renal disease 2012/7/31 2013/1/31 Phase 4 Clinical
Calcifediol Medical University of South Carolina 2013/1/31 2016/4/30 Phase 3 Clinical
Calcifediol Centre Hospitalier Universitaire de Nīmes Multiple sclerosis 2013/7/31 2017/6/30 Phase 3 Clinical
Calcifediol Indian Council For Medical Research 2010/8/31 2011/4/30 Phase 3 Clinical
Calcifediol - Launched
7

Safety Data of Calcifediol

Hazard Symbols : T+,F
Risk Statements : 28-48/25-26-24/25-11
Safety Statements : 28-36/37-45-16-7
WGKGermany : 3
8

Spectral Information

9

Suppliers List

Company Price and Availability Country/Region
Alfa Chemistry USA
BOC Sciences
Biochempartner Co., Ltd China
CHEMSCENE, LLC 5mg/USD132();100mg/USD1320() USA
Invitrogen Corporation USA
MedChemexpress Co., Ltd. 5mg/USD132();100mg/USD1320() USA
Pure Chemistry Scientific Inc. 100mg/USD124(In stock) USA
Selleck Chemicals LLC 5mg/USD120(In stock);10mM/1mLIn DMSO/USD190(In stock);25mg/USD470(In stock);100mg/USD1270(In stock) USA
Shanghai Haoyuan Chemexpress Co., Ltd. 5mg/USD132();100mg/USD1320() China
Target Molecule Corp. 5mg/USD99();100mg/USD548() USA
10

Related Products

Other Forms of 19356-17-3

Name CAS No Formula MW
Calcifediol (monohydrate) 63283-36-3 C27H44O2 400.64

Recommended Compounds in VD/VDR

Name CAS No Formula MW
25,26-Dihydroxyvitamin D3 29261-12-9 C27H44O3 416.64
(24R)-MC 976 112828-09-8 C27H42O3 414.62
(24S)-24,25-Dihydroxyvitamin D3 55700-58-8 C27H44O3 416.64
Calcitriol Impurities D 103656-40-2 C28H46O3 430.663
Calcifediol (monohydrate) 63283-36-3 C27H44O2 400.64
Cholecalciferol 67-97-0 C27H44O 384.64
(24S)-MC 976 112849-14-6 C27H42O3 414.62
(1S,4R,E)-4-((1R,3aS,7aR,E)-4-((Z)-2-((3S,5R)-3,5-bis((tert-butyldimethylsilyl)oxy)-2-methylenecyclohexylidene)ethylidene)-7a-methyloctahydro-1H-inden-1-yl)-1-cyclopropylpent-2-en-1-ol C39H68O3Si2 641.1264
VD3-D6 118584-54-6 C27H38D6O 390.67
VD2-D3 1217448-46-8 C28H41D3O 399.67
25-Hydroxy VD2-D6 1262843-46-8 C28H38D6O2 418.68
1alpha, 25-Dihydroxy VD2-D6 216244-04-1 C28H38D6O3 434.68
Calcipotriol (monohydrate) 147657-22-5 C27H42O4 430.62
Cholecalciferol 67-97-0 C27H44O 384.63766
Calcitriol Impurities A 73837-24-8 C27H44O3 416.6365
(1R,3S,E)-5-((E)-2-((1R,3aS,7aR)-1-((2R,5S,E)-5-cyclopropyl-5-hydroxypent-3-en-2-yl)-7a-methylhexahydro-1H-inden-4(2H)-ylidene)ethylidene)-4-methylenecyclohexane-1,3-diol 910133-70-9 C27H40O3 412.6047
Paricalcitol 131918-61-1 C27H44O3 416.64
MC 976 129831-99-8 C27H42O3 414.62
24R-Calcipotriol 112827-99-3 C27H40O3 412.6
MC 1046 126860-83-1 C27H38O3 410.59

Recommended Compounds in Same Indication

Name CAS No Formula MW
Cetirizine 83881-51-0 C21H25ClN2O3 388.89
Bardoxolone 218600-44-3 C31H41NO4 491.66
Bardoxolone (methyl) 218600-53-4 C32H43NO4 505.69
Cinacalcet (hydrochloride) 364782-34-3 C22H23ClF3N 393.87
Aleglitazar (racemate) 475479-24-4 C24H23NO5S 437.5081
Rolipram 61413-54-5 C16H21NO3 275.34
Dimethyl fumarate 624-49-7 C6H8O4 144.13
Cholecalciferol 67-97-0 C27H44O 384.64
Cinacalcet 226256-56-0 C22H22F3N 357.41
Calcitriol 32222-06-3 C27H44O3 416.64
MK-0812 624733-88-6 C24H34F3N3O3 469.54
Calcifediol (monohydrate) 63283-36-3 C27H44O2 400.64
Laquinimod 248281-84-7 C19H17ClN2O3 356.8
Curcumin 458-37-7 C21H20O6 368.38
Boceprevir 394730-60-0 C27H45N5O5 519.68
Firategrast 402567-16-2 C27H27F2NO6 499.5
Fingolimod (hydrochloride) 162359-56-0 C19H34ClNO2 343.93
Teriflunomide 163451-81-8 C12H9F3N2O2 270.21
Paricalcitol 131918-61-1 C27H44O3 416.64
Vitamin D2 50-14-6 C28H44O 396.64836
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Route of Synthesis

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References

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More Information

Calcifediol

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