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Cholesterol 3-Acetate-[d7]

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General Information
Catalog: BLP-002242
CAS: 1345629-08-4
Molecular Formula: C29H41D7O2
Molecular Weight: 435.73

Chemical Structure

Synonyms	(-)-Cholesteryl Acetate-d7; (3β)-Cholest-5-en-3-ol Acetate-d7; 3-Cholesteryl Acetate-d7; 3β-Acetoxycholest-5-ene-d7; Cholesterol 3-Acetate D7
IUPAC Name	[(3S,8S,9S,10R,13R,14S,17R)-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-3-yl] acetate
Related CAS	604-35-3 (unlabelled)
Canonical SMILES	CC(C)CCCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)OC(=O)C)C)C
InChI	InChI=1S/C29H48O2/c1-19(2)8-7-9-20(3)25-12-13-26-24-11-10-22-18-23(31-21(4)30)14-16-28(22,5)27(24)15-17-29(25,26)6/h10,19-20,23-27H,7-9,11-18H2,1-6H3/t20-,23+,24+,25-,26+,27+,28+,29-/m1/s1/i1D3,2D3,19D
InChI Key	XUGISPSHIFXEHZ-PETFRECNSA-N
Melting Point	112-114°C
Solubility	Soluble in Chloroform, Methanol
Appearance	White Solid
Storage	Store at -20°C, under inert atmosphere