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803111

25-Hydroxyvitamin D3-26,26,26,27,27,27-d6 sulfate sodium salt solution

100 μg/mL in ethanol, 98 atom % D, 97% (CP)

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About This Item

Empirical Formula (Hill Notation):
C27D6H37O5SNa
CAS Number:
99447-30-0
Molecular Weight:
508.72
MDL number:
MFCD28963800
UNSPSC Code:
12352106
PubChem Substance ID:
329768780
NACRES:
NA.12
Isotopic purity:
98 atom % D
Assay:
97% (CP)
Mass shift:
M+6
Form:
solution
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isotopic purity

98 atom % D

assay

97% (CP)

form

solution

concentration

100 μg/mL in ethanol

technique(s)

mass spectrometry (MS): suitable

color

colorless

application(s)

detection

mass shift

M+6

storage temp.

−20°C

SMILES string

C[C@H](CCCC(C([2H])([2H])[2H])(C([2H])([2H])[2H])O)C1CCC([C@]1(C)CCC/2)C2=C\C=C(C[C@@H](OS(=O)([O-])=O)CC3)/C3=C.[Na+]

InChI

1S/C27H44O5S.Na/c1-19-10-13-23(32-33(29,30)31)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)28;/h11-12,20,23-25,28H,1,6-10,13-18H2,2-5H3,(H,29,30,31);/q;+1/p-1/b21-11+,22-12-;/t20-,23+,24?,25?,27-;/m1./s1/i3D3,4D3;

InChI key

UVFUTTRHHIQISA-DZAJWRDGSA-M

General description

25-Hydroxyvitamin D3 (calcifediol) is a prohormone produced via hydroxylation of vitamin D3 (cholecalciferol) in the liver. It is a precursor for the synthesis of calcitriol {1,25-dihydroxyvitamin D3 or [1,25(OH)2D3]}. It is used as a biomarker to determine the status of vitamin D in the body.
25-Hydroxyvitamin D3-26,26,26,27,27,27-d6 sulfate sodium salt is a deuterated vitamin D3 wherein methyl protons of C-26, C-27 carbons are replaced by deuterium.

Application

25-Hydroxyvitamin D3-26,26,26,27,27,27-d6 sulfate sodium salt can be used as a stable isotope internal standard for data interpretation in specific biological samples by mass spectrometry.

pictograms

FlameExclamation mark
GHS02,GHS07

signalword

Danger

hcodes

H225,H319

Hazard Classifications

Eye Irrit. 2 - Flam. Liq. 2

Storage Class

3 - Flammable liquids

wgk

WGK 1

flash_point_f

57.2 °F - closed cup

flash_point_c

14.0 °C - closed cup

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