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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.

(3S,5S)-Dihydroxy Simvastatin-[d3]

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General Information
Catalog: BLP-002650
Molecular Formula: C25H37D3O7
Molecular Weight: 455.60
Chemical Structure
(3S,5S)-Dihydroxy Simvastatin-[d3]
Description (3S,5S)-Dihydroxy Simvastatin-[d3] is the labelled analogue of (3S,5S)-Dihydroxy Simvastatin, which is an impurity of Simvastatin. Simvastatin is a lipid-lowering drug that inhibits HMG-CoA reductase. It is in the statin class of medications and works by decreasing the manufacture of cholesterol by the liver.
Synonyms 3(s), 5(s)-Dihydroxy Simvastatin D3; 3S,5S-Dihydroxy Simvastatin-d3
IUPAC Name [(1S,3R,4S,6S,7R,8S,8aR)-4,6-dihydroxy-8-[2-[(2R,4R)-4-hydroxy-6-oxooxan-2-yl]ethyl]-3,7-dimethyl-1,2,3,4,6,7,8,8a-octahydronaphthalen-1-yl] 2-methyl-2-(trideuteriomethyl)butanoate
Related CAS 159143-77-8 (unlabelled)
Canonical SMILES CCC(C)(C)C(=O)OC1CC(C(C2=CC(C(C(C12)CCC3CC(CC(=O)O3)O)C)O)O)C
InChI InChI=1S/C25H40O7/c1-6-25(4,5)24(30)32-20-9-13(2)23(29)18-12-19(27)14(3)17(22(18)20)8-7-16-10-15(26)11-21(28)31-16/h12-17,19-20,22-23,26-27,29H,6-11H2,1-5H3/t13-,14-,15-,16-,17+,19-,20+,22-,23+/m1/s1/i4D3/t13-,14-,15-,16-,17+,19-,20+,22-,23+,25?
InChI Key MRCKOKWQDZYFLT-RWYAJWGZSA-N
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