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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.

Chenodeoxycholic Acid-[13C]

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General Information
Catalog: BLP-009194
CAS: 52918-92-0
Molecular Formula: C23[13C]H40O4
Molecular Weight: 393.57
Chemical Structure
Chenodeoxycholic Acid-[13C]
Description Chenodeoxycholic Acid-[24-13C], is the labelled analogue of Chenodeoxycholic acid, Chenodeoxycholic acid has been used as medical therapy to dissolve gallstones.
Synonyms Chenodeoxycholic Acid-13C; Chenodeoxycholic-24-13C Acid; (3α,5β,7α)-3,7-Dihydroxycholan-24-oic-13C Acid; (+)-Chenodeoxycholic-13C Acid; 17β-(1-Methyl-3-carboxypropyl)etiocholane-3α,7α-diol-13C; Chenodiol-13C; Chendol-13C; Chenocol-13C; Fluibil-13C; Chenodeoxycholic-13C Acid
IUPAC Name (4R)-4-[(3R,5S,7R,8R,9S,10S,13R,14S,17R)-3,7-dihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl](1-13C)pentanoic acid
Related CAS 474-25-9 (unlabelled)
Canonical SMILES CC(CCC(=O)O)C1CCC2C1(CCC3C2C(CC4C3(CCC(C4)O)C)O)C
InChI InChI=1S/C24H40O4/c1-14(4-7-21(27)28)17-5-6-18-22-19(9-11-24(17,18)3)23(2)10-8-16(25)12-15(23)13-20(22)26/h14-20,22,25-26H,4-13H2,1-3H3,(H,27,28)/t14-,15+,16-,17-,18+,19+,20-,22+,23+,24-/m1/s1/i21+1
InChI Key RUDATBOHQWOJDD-NIOAGLPLSA-N
Melting Point 165-167°C
Purity 98%; 99% atom 13C
Solubility Slightly soluble in Dioxane, DMSO, Methanol
Appearance Solid
Storage Store at RT
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