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Application Area
Environmental
Environmental

Stable isotope-labeled compounds are used as environmental pollutant standards for the detection of air, water, soil, sediment and food.

Clinical diagnostic
Clinical diagnostic

In addition to treating various diseases, isotopes are used for imaging, diagnosis, and newborn screening.

Organic Chemistry
Organic Chemistry

Small molecule compounds labeled with stable isotopes can be used as chemical reference for chemical identification, qualitative, quantitative, detection, etc. Various types of NMR solvents can be used to study the structure, reaction mechanism and reaction kinetics of compounds.

Metabolic Research
Metabolic Research

Stable isotope labeling allows researchers to study metabolic pathways in vivo in a safe manner.

4-Cholesten-3-one-[2,2,4,6,6-d5]

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General Information
Catalog: BLP-007251
CAS: 72560-60-2
Molecular Formula: C27H39D5O
Molecular Weight: 389.67
Chemical Structure
4-Cholesten-3-one-[2,2,4,6,6-d5]
Description 4-Cholesten-3-one-[2,2,4,6,6-d5] is the labelled analogue of 4-Cholesten-3-one, which is an intestinal metabolite of Cholesterol with anti-obesity effect on animals.
Synonyms 4-Cholesten-3-one-2,2,4,6,6-D5; Δ4-Cholesten-3-one-d5; (+)-4-Cholesten-3-one-d5; (17β)-17-Octylandrost-4-en-3-one-d5; 3-Oxocholest-4-ene-d5; Δ4-Cholestenone-d5; 4-Cholesten-3-one-d5; 4-Cholestenone-d5; Cholesterone-d5; NSC 134926-d5
IUPAC Name (8S,9S,10R,13R,14S,17R)-2,2,4,6,6-pentadeuterio-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-1,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-3-one
Related CAS 601-57-0 (unlabelled)
Canonical SMILES CC(C)CCCC(C)C1CCC2C1(CCC3C2CCC4=CC(=O)CCC34C)C
InChI InChI=1S/C27H44O/c1-18(2)7-6-8-19(3)23-11-12-24-22-10-9-20-17-21(28)13-15-26(20,4)25(22)14-16-27(23,24)5/h17-19,22-25H,6-16H2,1-5H3/t19-,22+,23-,24+,25+,26+,27-/m1/s1/i9D2,13D2,17D
InChI Key NYOXRYYXRWJDKP-WXOWQUKUSA-N
Melting Point 80-82°C
Purity ≥99%; ≥98% atom D
Solubility Slightly soluble in Chloroform, Ethyl Acetate, Methanol
Appearance White to Off-white Solid
Storage Store at -20°C
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