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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.

Taurocholic acid-[d5]

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General Information
Catalog: BLP-004537
CAS: 2044276-13-1
Molecular Formula: C26H40D5NO7S
Molecular Weight: 520.73
Chemical Structure
Taurocholic acid-[d5]
Description Labelled analogue of Taurocholic acid. Taurocholic acid is a choleretic steroid produced from the conjugation of cholic acid with taurine. It can be used as a cholagogue and cholerectic.
Synonyms 2-​[[(3α,​5β,​7α,​12α)​-​3,​7,​12-​trihydroxy-​24-​oxocholan-​24-​yl-​2,​2,​3,​4,​4-​d5]​amino]​-Ethanesulfonic acid; Taurocholic-2,2,3,4,4-D5 acid
IUPAC Name 2-[[(4R)-4-[(3R,5S,7R,8R,9S,10S,12S,13R,14S,17R)-2,2,3,4,4-pentadeuterio-3,7,12-trihydroxy-10,13-dimethyl-1,5,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-17-yl]pentanoyl]amino]ethanesulfonic acid
Related CAS 81-24-3 (unlabelled)
Canonical SMILES CC(CCC(=O)NCCS(=O)(=O)O)C1CCC2C1(C(CC3C2C(CC4C3(CCC(C4)O)C)O)O)C
InChI InChI=1S/C26H45NO7S/c1-15(4-7-23(31)27-10-11-35(32,33)34)18-5-6-19-24-20(14-22(30)26(18,19)3)25(2)9-8-17(28)12-16(25)13-21(24)29/h15-22,24,28-30H,4-14H2,1-3H3,(H,27,31)(H,32,33,34)/t15-,16+,17-,18-,19+,20+,21-,22+,24+,25+,26-/m1/s1/i8D2,12D2,17D
InChI Key WBWWGRHZICKQGZ-DXDDMVLESA-N
Purity >98%
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