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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.

Entecavir-[13C,15N,d2]

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General Information
Catalog: BLP-007832
Molecular Formula: C11[13C]H13D2N4[15N]O3
Molecular Weight: 281.30
Chemical Structure
Entecavir-[13C,15N,d2]
Description Entecavir-[13C,15N,d2] is the labelled analogue of Entecavir, which is an oral antiviral drug used in the treatment of hepatitis B infection.
Synonyms Entecavir-d2,15N,13C; 2-Amino-1,9-dihydro-9-[(1S,3R,4S)-4-hydroxy-3-(hydroxymethyl)-2-methylenecyclopentyl]-6H-Purin-6-one-d2,15N,13C; Baraclude-d2,15N,13C; 2-amino-9-((1S,3R,4S)-4-hydroxy-3-(hydroxymethyl)-2-(methylene-d2)cyclopentyl)-1,9-dihydro-6H-purin-6-one-8-13C-7-15N
IUPAC Name 2-amino-9-[(1S,3R,4S)-2-(dideuteriomethylidene)-4-hydroxy-3-(hydroxymethyl)cyclopentyl]-1H-purin-6-one-8-13C-7-15N
Related CAS 142217-69-4 (unlabelled)
Canonical SMILES C=C1C(CC(C1CO)O)N2C=NC3=C2N=C(NC3=O)N
InChI InChI=1S/C12H15N5O3/c1-5-6(3-18)8(19)2-7(5)17-4-14-9-10(17)15-12(13)16-11(9)20/h4,6-8,18-19H,1-3H2,(H3,13,15,16,20)/t6-,7-,8-/m0/s1/i1D2,4+1,14+1
InChI Key QDGZDCVAUDNJFG-UKZIBYOZSA-N
Solubility Slightly soluble in DMSO; Sparingly soluble in Methanol
Appearance Off-white Solid
Storage Store at -20°C
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