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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.

5-Hydroxysaxagliptin-[13C,d2] TFA Salt

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General Information
Catalog: BLP-012994
Molecular Formula: C17[13C]H23D2N3O3.C2HF3O2
Molecular Weight: 448.44
Chemical Structure
5-Hydroxysaxagliptin-[13C,d2] TFA Salt
Description 5-Hydroxysaxagliptin-[13C,d2] TFA Salt is the labelled analogue of 5-Hydroxysaxagliptin TFA Salt, which is an impurity of Saxagliptin. Saxagliptin is a dipeptidyl peptidase-4 (DPP-4) inhibitor.
Synonyms 5-Hydroxysaxagliptin-13C,d2 TFA Salt; (1S,3S,5R)-2-((2S)-2-amino-2-(3,5-dihydroxyadamantan-1-yl)acetyl)-2-azabicyclo[3.1.0]hexane-3-carbonitrile-13C,D2 2,2,2-trifluoroacetate
IUPAC Name (1S,3S,5S)-2-[(2S)-2-amino-2-[(3R,5S)-3,5-dihydroxy-1-adamantyl]acetyl-13C]-6,6-dideuterio-2-azabicyclo[3.1.0]hexane-3-carbonitrile;2,2,2-trifluoroacetic acid
Related CAS 841302-57-6 (unlabelled) 841301-24-7 (unlabelled free base)
Canonical SMILES C1C2CC2N(C1C#N)C(=O)C(C34CC5CC(C3)(CC(C5)(C4)O)O)N.C(=O)(C(F)(F)F)O
InChI InChI=1S/C18H25N3O3.C2HF3O2/c19-6-12-1-11-2-13(11)21(12)15(22)14(20)16-3-10-4-17(23,7-16)9-18(24,5-10)8-16;3-2(4,5)1(6)7/h10-14,23-24H,1-5,7-9,20H2;(H,6,7)/t10?,11-,12+,13+,14-,16?,17-,18+;/m1./s1/i2D2,15+1;
InChI Key QTNILWSCWDCLTO-MDZSKCMISA-N
Purity 95% by HPLC; 98% atom D, 98% atom 13C
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