ABC01359RD

Taurocholic Acid Sodium Salt

Sodium salt of taurocholic acid, a conjugate of 3ฮฑ-hydroxy-5ฮฒ-cholan-24-oic acid and taurine, featuring a sulfate ester at C24 and a carboxylate group complexed with sodium. This compound arises as a synthetic byproduct during parent drug formulation, differing by ionic substitution at the terminal carboxylic acid. Serves as an HPLC reference standard for quantifying impurity profiles in taurocholic acid-based pharmaceuticals.

On Request
Molecular Formula C26H46NNaO8S
Molecular Weight 555.7000
CAS Number 345909-26-4 โœ“ Verified
PubChem CID 23687511 โ†—
Purity N/A
Product Type API Impurity
Parent Drug Taurocholic
Lead Time On Request
IUPAC Name sodium;2-[[(4R)-4-[(3R,5S,7R,8R,9S,10S,12S,13R,14S,17R)-3,7,12-trihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoyl]amino]ethanesulfonate;hydrate
Other CAS Numbers (also listed on PubChem)
312693-83-7

๐Ÿ“ Synonyms

sodium taurocholate monohydrate WOX5F63THK RefChem:1098861 Taurocholic acid sodium salt hydrate 345909-26-4 312693-83-7 MLS002153446 sodium;2-[[(4R)-4-[(3R,5S,7R,8R,9S,10S,12S,13R,14S,17R)-3,7,12-trihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoyl]amino]ethanesulfonate;hydrate Taurocholic Acid (sodium hydrate) Sodium taurocholate dihydrate

๐Ÿ”ฌ Chemical Identifiers

C[C@H](CCC(=O)NCCS(=O)(=O)[O-])[C@H]1CC[C@@H]2[C@@]1([C@H](C[C@H]3[C@H]2[C@@H](C[C@H]4[C@@]3(CC[C@H](C4)O)C)O)O)C.O.[Na+]
InChI=1S/C26H45NO7S.Na.H2O/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);;1H2/q;+1;/p-1/t15-,16+,17-,18-,19+,20+,21-,22+,24+,25+,26-;;/m1../s1
RDAJAQDLEFHVNR-NEMAEHQESA-M

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