Glycocholic acid-d4

For research use only. Not for therapeutic Use.

  • CAT Number: R067047
  • CAS Number: 1201918-15-1
  • Molecular Formula: C26H39D4NO6
  • Molecular Weight: 469.65
  • Purity: ≥95%
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Glycocholic acid-d₄(Cat No.:R067047)is a stable isotope-labeled version of glycocholic acid, incorporating four deuterium atoms for enhanced detection in analytical studies. As a conjugated bile acid (cholic acid linked to glycine), it plays a key role in lipid emulsification and bile acid metabolism. The d₄ label allows for accurate quantification and metabolic tracing in LC-MS-based lipidomics and pharmacokinetic research. It is particularly useful as an internal standard in studies of liver function, bile acid biosynthesis, and gastrointestinal health.


CAS Number 1201918-15-1
Synonyms

2-[[(4R)-4-[(3R,5S,7R,8R,9S,10S,12S,13R,14S,17R)-2,2,4,4-tetradeuterio-3,7,12-trihydroxy-10,13-dimethyl-3,5,6,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoyl]amino]acetic acid

Molecular Formula C26H39D4NO6
Purity ≥95%
IUPAC Name 2-[[(4R)-4-[(3R,5S,7R,8R,9S,10S,12S,13R,14S,17R)-2,2,4,4-tetradeuterio-3,7,12-trihydroxy-10,13-dimethyl-3,5,6,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoyl]amino]acetic acid
InChI InChI=1S/C26H43NO6/c1-14(4-7-22(31)27-13-23(32)33)17-5-6-18-24-19(12-21(30)26(17,18)3)25(2)9-8-16(28)10-15(25)11-20(24)29/h14-21,24,28-30H,4-13H2,1-3H3,(H,27,31)(H,32,33)/t14-,15+,16-,17-,18+,19+,20-,21+,24+,25+,26-/m1/s1/i8D2,10D2
InChIKey RFDAIACWWDREDC-WZQUIQSLSA-N
SMILES [2H]C1(C[C@@]2([C@H]3C[C@@H]([C@]4([C@H]([C@@H]3[C@@H](C[C@@H]2C([C@@H]1O)([2H])[2H])O)CC[C@@H]4[C@H](C)CCC(=O)NCC(=O)O)C)O)C)[2H]
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