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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.

2'-Deoxy-3',5'-di-O-benzoyl-2',2'-difluorocytidine-[13C,15N2]

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General Information
Catalog: BLP-012723
CAS: 1267650-42-9
Molecular Formula: C22[13C]H19F2N[15N]2O6
Molecular Weight: 474.39
Chemical Structure
2'-Deoxy-3',5'-di-O-benzoyl-2',2'-difluorocytidine-[13C,15N2]
Description 2'-Deoxy-3',5'-di-O-benzoyl-2',2'-difluorocytidine-[13C,15N2] is the labelled analogue of 2'-Deoxy-3',5'-di-O-benzoyl-2',2'-difluorocytidine, which is a β-anomer intermediate of Gemcitabine. It is an antitumor compound.
Synonyms 2'-Deoxy-3',5'-di-O-benzoyl-2',2'-difluorocytidine-13C,15N2; 2'-Deoxy-2',2'-difluoro-3',5'-bis-O-benzoylcytidine-13C,15N2
IUPAC Name (2R,3R,5R)-5-(4-amino-2-oxopyrimidin-1(2H)-yl-2-13C-1,3-15N2)-2-((benzoyloxy)methyl)-4,4-difluorotetrahydrofuran-3-yl benzoate
Related CAS 134790-39-9 (unlabelled)
Canonical SMILES C1=CC=C(C=C1)C(=O)OCC2C(C(C(O2)N3C=CC(=NC3=O)N)(F)F)OC(=O)C4=CC=CC=C4
InChI InChI=1S/C23H19F2N3O6/c24-23(25)18(34-20(30)15-9-5-2-6-10-15)16(13-32-19(29)14-7-3-1-4-8-14)33-21(23)28-12-11-17(26)27-22(28)31/h1-12,16,18,21H,13H2,(H2,26,27,31)/t16-,18-,21-/m1/s1/i22+1,27+1,28+1
InChI Key ZPUUYUUQQGBHBU-PQKBPNRGSA-N
Purity 98%
Solubility Soluble in DMSO, Ethyl Acetate (Hot)
Appearance Tan Solid
Storage Store at 2-8°C
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