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63283-36-3 (Calcifediol (monohydrate))

1

Identification

Calcifediol (monohydrate) Calcifediol (monohydrate)
Name Calcifediol (monohydrate)
Formula C27H44O2
MW 400.64
CAS No. 63283-36-3
EINECS 242-990-9
Smiles O[[email protected]](C/C1=C/C=C2C3CC[[email protected]@H]([[email protected]]3(CCC/2)C)[[email protected]](C)CCCC(C)(O)C)CCC1=C
Synonyms (5Z,7E)-9,10-Secocholesta-5,7,10(19)-triene-3b,25-diol monohydrate; 25-Hydroxycholecalciferol monohydrate; 25-OHD3; 25-Hydroxyvitamin D3 monohydrate; (1S,Z)-3-((E)-2-((1R,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 monohydrate(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

Calcifediol monohydrate(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. ......by AdooQ BioScience, LLC
Calcifediol monohydrate is a prehormone that is produced in the liver by hydroxylation of vitamin D3 (cholecalciferol) by the enzyme cholecalciferol 25-hydroxylase. It can be converted into 24-hydroxycalcidiol in the kidneys via 24-hydroxylation. ......by BOC Sciences
Calcifediol (monohydrate) 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 prehormone that is produced in the liver. Physicians worldwide measure this metabolite to determine a patient's vitamin D status. The blood concentration of calcifediol is considered the best indicator of vitamin D status. ......by MedKoo Biosciences, Inc.
The major circulating metabolite of vitamin D3; it is produced in the liver and is the best indicator of the body's vitamin D stores; it is effective in the treatment of RICKETS and OSTEOMALACIA, both in azotemic and non-azotemic patients; also has mineralizing properties.OsteoporosisApproved ......by ProbeChem
3

Protocol(Only for Reference)

Cell Experiment

Animal Experiment

4

Physical and Chemical Properties

Appearance:White to off-white solid EBNumber:EB000018712

Storage condition

Solubility

Chloroform, Methanol by MedChemexpress Co., Ltd.
5

Mechanism and Indication

Signaling Pathways Others
Target VD/VDR
Research Area Metabolic Disease
Indications Prostate tumor End stage renal disease
6

Clinical Information

Product Name Sponsor & Collaborators Indications Start Date End Date Phase
Calcifediol (monohydrate) Indian Council For Medical Research 2010/8/31 2011/4/30 Phase 3 Clinical
Calcifediol (monohydrate) US Department of Veterans Affairs Prostate tumor 2013/1/31 2017/12/31 Phase 2 Clinical
Calcifediol (monohydrate) Seoul National University Hospital End stage renal disease 2012/7/31 2013/1/31 Phase 4 Clinical
Calcifediol (monohydrate) Centre Hospitalier Universitaire De Quebec 2012/10/31 2014/12/31 Phase 2 Clinical
Calcifediol (monohydrate) - Launched
7

Safety Data of Calcifediol (monohydrate)

Hazard Symbols : T+
Risk Statements : R28
Safety Statements : S28;S36/37;S45
Transport Information : UN 2811
WGKGermany : 3
8

Spectral Information

9

Suppliers List

Company Price and Availability Country/Region
AdooQ BioScience, LLC USA
Apexbio Technology LLC USA
Ark Pharm, Inc. USA
BOC Sciences
Biochempartner Co., Ltd China
CHEMSCENE, LLC 5mg/USD132();100mg/USD1320() USA
Carbosynth Limited 10mg/USD65()
Hydragon Pharma Co., Ltd. China
Invitrogen Corporation USA
MedChemexpress Co., Ltd. 5mg/USD132();100mg/USD1320() USA
MedKoo Biosciences, Inc. USA
ProbeChem
Pure Chemistry Scientific Inc. 100mg/USD241(In stock) USA
Santa Cruz Biotechnology, Inc. 1mg/USD99() USA
Shanghai Haoyuan Chemexpress Co., Ltd. 5mg/USD132();100mg/USD1320() China
Sichuan Industrial Institute of Antibiotics Co., Ltd. China
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Related Products

Other Forms of 63283-36-3

Name CAS No Formula MW
Calcifediol 19356-17-3 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
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
3-O-(2-Aminoethyl)-25-hydroxyvitamin D3 163018-26-6 C30H51NO2 457.73

Recommended Compounds in Same Indication

Name CAS No Formula MW
Bicalutamide 90357-06-5 C18H14F4N2O4S 430.37
Fenretinide 65646-68-6 C26H33NO2 391.55
Leuprolide (Acetate) 74381-53-6 C61H88N16O14 1269.45
Ganetespib 888216-25-9 C20H20N4O3 364.4
Bardoxolone 218600-44-3 C31H41NO4 491.66
Bardoxolone (methyl) 218600-53-4 C32H43NO4 505.69
Tasquinimod 254964-60-8 C20H17F3N2O4 406.36
Cinacalcet (hydrochloride) 364782-34-3 C22H23ClF3N 393.87
Aleglitazar (racemate) 475479-24-4 C24H23NO5S 437.5081
RO4929097 847925-91-1 C22H20F5N3O3 469.4
Zibotentan 186497-07-4 C19H16N6O4S 424.43
Cinacalcet 226256-56-0 C22H22F3N 357.41
Calcitriol 32222-06-3 C27H44O3 416.64
Genistein 446-72-0 C15H10O5 270.24
Calcifediol 19356-17-3 C27H44O2 400.64
Curcumin 458-37-7 C21H20O6 368.38
Boceprevir 394730-60-0 C27H45N5O5 519.68
Dutasteride 164656-23-9 C27H30F6N2O2 528.53
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 (monohydrate)

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