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163217-09-2

163217-09-2 Structure

163217-09-2 Structure
IdentificationBack Directory
[Name]

INECALCITOL
[CAS]

163217-09-2
[Synonyms]

INECALCITOL
Ridinilazole
(7E)-19-Nor-9,10-seco-14b-cholesta-5,7-dien-23-yne-1a,3b,25-triol
1,3-Cyclohexanediol,5-[(2E)-2-[(1R,3aR,7aR)-octahydro-1-[(1R)-5-hydroxy-1,5-diMethyl-3-hexyn-1-yl]-7a-Methyl-4H-inden-4-ylidene]ethylidene]-,(1R,3R)-
(1R,3R)-5-[(2E)-2-[(1R,3aR,7aR)-1-[(2R)-6-hydroxy-6-methylhept-4-yn-2-yl]-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]ethylidene]cyclohexane-1,3-diol
[Molecular Formula]

C26H40O3
[MDL Number]

MFCD09837757
[MOL File]

163217-09-2.mol
[Molecular Weight]

400.59
Chemical PropertiesBack Directory
[Boiling point ]

568.6±50.0 °C(Predicted)
[density ]

1.163
[storage temp. ]

4°C, protect from light, stored under nitrogen
[solubility ]

DMSO: Soluble
[form ]

Solid
[pka]

13.12±0.29(Predicted)
[color ]

Off-white to light yellow
Hazard InformationBack Directory
[Uses]

Inecalcitol is a derivative of Vitamin D (V676045), the vitamin that mediates intestinal calcium absorbtion, bone calcium metabolism and probably, muscle activity. It occurs in and is isolated from fish liver oils.
[storage]

4°C, protect from light, stored under nitrogen
[References]

[1] GUY EELEN. Superagonistic action of 14-epi-analogs of 1,25-dihydroxyvitamin D explained by vitamin D receptor-coactivator interaction.[J]. Molecular Pharmacology, 2005, 67 5: 1566-1573. DOI: 10.1124/mol.104.008730
[2] L VERLINDEN. Two novel 14-Epi-analogues of 1,25-dihydroxyvitamin D3 inhibit the growth of human breast cancer cells in vitro and in vivo.[J]. Cancer research, 2000, 60 10: 2673-2679.
[3] PETRA DE HAES . 1,25-Dihydroxyvitamin D3 and analogues protect primary human keratinocytes against UVB-induced DNA damage[J]. Journal of photochemistry and photobiology. B, Biology, 2005, 78 2: Pages 141-148. DOI: 10.1016/j.jphotobiol.2004.09.010
[4] MICHAEL S K WONG. Vitamin D derivatives acutely reduce endothelium-dependent contractions in the aorta of the spontaneously hypertensive rat.[J]. American journal of physiology. Heart and circulatory physiology, 2008, 295 1: H289-96. DOI: 10.1152/ajpheart.00116.2008
Spectrum DetailBack Directory
[Spectrum Detail]

INECALCITOL(163217-09-2)1HNMR
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