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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.

2-Oxo Clopidogrel-[13C,d3] Hydrochloride (Mixture of Diastereomers)

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General Information
Catalog: BLP-006376
CAS: 1794713-84-0
Molecular Formula: C15[13C]H13D3ClNO3S.HCl
Molecular Weight: 378.29
Chemical Structure
2-Oxo Clopidogrel-[13C,d3] Hydrochloride (Mixture of Diastereomers)
Description 2-Oxo Clopidogrel-[13C,d3] Hydrochloride (Mixture of Diastereomers) is the labelled salt of 2-Oxo Clopidogrel. 2-Oxo Clopidogrel is the essential intermediate metabolite from which the active metabolite of Clopidogel is formed.
Synonyms 2-Oxo Clopidogrel-13C,d3 Hydrochloride (Mixture of Diastereomers); α-(2-Chlorophenyl)-2,6,7,7a-tetrahydro-2-oxo-thieno[3,2-c]pyridine-5(4H)-acetic Acid Methyl Ester-13C,d3 Hydrochloride
IUPAC Name trideuterio(1-13C)methyl 2-(2-chlorophenyl)-2-(2-oxo-4,6,7,7a-tetrahydrothieno[3,2-c]pyridin-5-yl)acetate;hydrochloride
Related CAS 1219432-42-4 (unlabelled) 109904-27-0 (unlabelled free base)
Canonical SMILES COC(=O)C(C1=CC=CC=C1Cl)N2CCC3C(=CC(=O)S3)C2.Cl
InChI InChI=1S/C16H16ClNO3S.ClH/c1-21-16(20)15(11-4-2-3-5-12(11)17)18-7-6-13-10(9-18)8-14(19)22-13;/h2-5,8,13,15H,6-7,9H2,1H3;1H/i1+1D3;
InChI Key KCFLQPXPVKZERK-SPZGMPHYSA-N
Melting Point >148°C (dec.)
Purity 97%; 97% atom 13C, 97% atom D
Solubility Slightly soluble in DMSO; Very slightly soluble in Methanol
Appearance Off-white to Pale Beige Solid
Storage Store at -20°C under inert atmosphere
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