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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.

Tauroursodeoxycholic Acid-[d4] Sodium

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General Information
Catalog: BLP-006576
CAS: 2410279-95-5
Molecular Formula: C26H40D4NNaO6S
Molecular Weight: 525.71
Chemical Structure
Tauroursodeoxycholic Acid-[d4] Sodium
Description Tauroursodeoxycholic Acid-[d4] Sodium is the labelled salt of Tauroursodeoxycholic Acid, which inhibits human cholangiocarcinoma growth via Ca2+-, PKC- and MAPK-dependent pathways.
Synonyms Tauroursodeoxycholic Acid-D4 Sodium; Sodium tauroursodeoxycholate-d4; Tauroursodeoxycholate-d4 Sodium; Ursodeoxycholyltaurine-d4 sodium
IUPAC Name sodium;2-[[(4R)-4-[(3R,5S,7S,10S,13R,17R)-2,2,4,4-tetradeuterio-3,7-dihydroxy-10,13-dimethyl-3,5,6,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoyl]amino]ethanesulfonate
Related CAS 35807-85-3 (unlabelled) 14605-22-2 (unlabelled free acid)
Canonical SMILES CC(CCC(=O)NCCS(=O)(=O)[O-])C1CCC2C1(CCC3C2C(CC4C3(CCC(C4)O)C)O)C.[Na+]
InChI InChI=1S/C26H45NO6S.Na/c1-16(4-7-23(30)27-12-13-34(31,32)33)19-5-6-20-24-21(9-11-26(19,20)3)25(2)10-8-18(28)14-17(25)15-22(24)29;/h16-22,24,28-29H,4-15H2,1-3H3,(H,27,30)(H,31,32,33);/q;+1/p-1/t16-,17+,18-,19-,20?,21?,22+,24?,25+,26-;/m1./s1/i8D2,14D2;
InChI Key IYPNVUSIMGAJFC-RFGWCAJESA-M
Purity >99% by HPLC; >98% atom D
Solubility Soluble in DMSO, Methanol, THF
Appearance White Solid
Shelf Life 1 Year
Storage Store at -20°C
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