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Application Area
Metabolic Research
Metabolic Research

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

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.

Environmental
Environmental

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

Asciminib-[13C6]

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General Information
Catalog: BLP-000978
Molecular Formula: C14[13C]6H18ClF2N5O3
Molecular Weight: 455.80
Chemical Structure
Asciminib-[13C6]
Description Asciminib-[13C6] is the labelled analogue of Asciminib. Asciminib, also known as ABL-001, is a potent and selective allosteric Bcr-Abl inhibitor. Asciminib inhibits Ba/F3 cell growth with an IC50 of 0.25 nM.
Synonyms [13C6]-Asciminib; [13C6]-ABL001; [13C6]-ABL-001; [13C6]-L1F3R18W77; [13C6]-UNII-L1F3R18W77; (R)-N-(4-(chlorodifluoromethoxy)phenyl-1,2,3,4,5,6-13C6)-6-(3-hydroxypyrrolidin-1-yl)-5-(1H-pyrazol-5-yl)nicotinamide
IUPAC Name N-[4-[chloro(difluoro)methoxy](1,2,3,4,5,6-13C6)cyclohexa-1,3,5-trien-1-yl]-6-[(3R)-3-hydroxypyrrolidin-1-yl]-5-(1H-pyrazol-5-yl)pyridine-3-carboxamide
Related CAS 1492952-76-7 (unlabelled)
Canonical SMILES C1CN(CC1O)C2=C(C=C(C=N2)C(=O)NC3=CC=C(C=C3)OC(F)(F)Cl)C4=CC=NN4
InChI InChI=1S/C20H18ClF2N5O3/c21-20(22,23)31-15-3-1-13(2-4-15)26-19(30)12-9-16(17-5-7-25-27-17)18(24-10-12)28-8-6-14(29)11-28/h1-5,7,9-10,14,29H,6,8,11H2,(H,25,27)(H,26,30)/t14-/m1/s1/i1+1,2+1,3+1,4+1,13+1,15+1
InChI Key VOVZXURTCKPRDQ-OIPSRKIYSA-N
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