Name: Vitamin D3-[d7]
Brand: BOC Sciences
Rating: 5 (1 reviews)

General Information

Catalog: BLP-012658

CAS: 1627523-19-6

Molecular Formula: C27H37D7O

Molecular Weight: 391.68

Chemical Structure

Description	Vitamin D3-[d7] is the labelled analogue of Vitamin D3, which has been found to be effective in mediating intestinal calcium absorbtion and bone calcium metabolism.
Synonyms	(3β,5Z,7E)-9,10-Secocholesta-5,7,10(19)-trien-3-ol-d7; Vitamin D3-d7
IUPAC Name	(1S,3Z)-3-[(2E)-2-[(1R,3aS,7aR)-7a-methyl-1-[(2R)-6,7,7,7-tetradeuterio-6-(trideuteriomethyl)heptan-2-yl]-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]ethylidene]-4-methylidenecyclohexan-1-ol
Related CAS	67-97-0 (unlabelled)
Canonical SMILES	[2H]C([2H])([2H])C([2H])(CCC[C@@H](C)[C@H]1CC[C@H]2\C(=C\C=C/3\C[C@@H](O)CCC3=C)\CCC[C@]12C)C([2H])([2H])[2H]
InChI	InChI=1S/C27H44O/c1-19(2)8-6-9-21(4)25-15-16-26-22(10-7-17-27(25,26)5)12-13-23-18-24(28)14-11-20(23)3/h12-13,19,21,24-26,28H,3,6-11,14-18H2,1-2,4-5H3/b22-12+,23-13-/t21-,24+,25-,26+,27-/m1/s1/i1D3,2D3,19D
InChI Key	QYSXJUFSXHHAJI-UIEYODRWSA-N
Boiling Point	496.4±24.0 °C at 760 mmHg
Melting Point	>45 °C (dec.)
Purity	95% by HPLC; 95% atom D
Density	1.0±0.1 g/cm3
Solubility	Soluble in Chloroform, Ethyl Acetate, Methanol
Appearance	White to Pale Yellow Oil to Solid