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4β-Hydroxy Cholesterol 4-Acetate-[d7]

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General Information
Catalog: BLP-002979
CAS: 1363529-54-7
Molecular Formula: C29H41D7O3
Molecular Weight: 451.73

Chemical Structure

Description	4β-Hydroxy Cholesterol 4-Acetate-[d7] is the labelled analogue of 4β-Hydroxy Cholesterol 4-Acetate, which is a metabolite of Cholesterol.
Synonyms	4β-Hydroxy Cholesterol-d7 4-Acetate; (3β,4β)-Cholest-5-ene-3,4-diol-d7 4-Acetate; 4β-Acetoxycholest-5-en-3β-ol-d7
IUPAC Name	[(3S,4R,8S,9S,10R,13R,14S,17R)-3-hydroxy-10,13-dimethyl-17-[(2R)-6,7,7,7-tetradeuterio-6-(trideuteriomethyl)heptan-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-4-yl] acetate
Related CAS	2515-18-6 (unlabelled)
Canonical SMILES	CC(C)CCCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4OC(=O)C)O)C)C
InChI	InChI=1S/C29H48O3/c1-18(2)8-7-9-19(3)22-12-13-23-21-10-11-25-27(32-20(4)30)26(31)15-17-29(25,6)24(21)14-16-28(22,23)5/h11,18-19,21-24,26-27,31H,7-10,12-17H2,1-6H3/t19-,21+,22-,23+,24+,26+,27-,28-,29-/m1/s1/i1D3,2D3,18D
InChI Key	CPAJTVKFJMIGFR-XOBJRHKLSA-N
Purity	97%; ≥ 97% atom D
Solubility	Slightly soluble in Chloroform, Methanol
Appearance	White Solid
Storage	-20 °C