CAS 75808-01-4

2-[[(3α,5β)-3-Hydroxy-7,24-dioxocholan-24-yl]amino]ethanesulfonic acid

Description:

2-[[(3α,5β)-3-Hydroxy-7,24-dioxocholan-24-yl]amino]ethanesulfonic acid, commonly referred to as a bile acid derivative, is a complex organic compound characterized by its steroidal structure, which includes a hydroxyl group and a sulfonic acid moiety. This compound is notable for its role in biological systems, particularly in the context of bile acid metabolism and its potential applications in biochemistry and pharmacology. The presence of the sulfonic acid group contributes to its solubility in aqueous environments, making it useful in various biochemical assays and as a potential buffer component. Its structural features, including the steroid backbone and functional groups, influence its interactions with biological membranes and proteins. Additionally, this compound may exhibit specific biological activities, such as modulating enzyme functions or influencing cellular signaling pathways. Overall, its unique structure and properties make it a subject of interest in research related to metabolism and drug development.

Formula: C₂₆H₄₃NO₆S

InChI: InChI=1S/C26H43NO6S/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/h16-21,24,28H,4-15H2,1-3H3,(H,27,30)(H,31,32,33)/t16-,17+,18-,19-,20+,21+,24+,25+,26-/m1/s1

InChI key: InChIKey=QNRIYEYAHVEGQJ-SWQVIYSDSA-N

SMILES: C[C@@]12[C@]([C@]3([C@@]([C@]4(C)[C@](CC3=O)(C[C@H](O)CC4)[H])(CC1)[H])[H])(CC[C@@]2([C@@H](CCC(NCCS(=O)(=O)O)=O)C)[H])[H]

Synonyms:

• 3α-Hydroxy-7-oxocholanoyltaurine
• 7-Oxolithocholic acid-taurine conjugate
• 7-Ketolithocholic acid-taurine conjugate
• Ethanesulfonic acid, 2-[[(3α,5β)-3-hydroxy-7,24-dioxocholan-24-yl]amino]-
• 2-[[(3α,5β)-3-Hydroxy-7,24-dioxocholan-24-yl]amino]ethanesulfonic acid

3α-Hydroxy-7-oxocholanoyltaurine

CAS: 75808-01-4

3α-Hydroxy-7-oxocholanoyltaurine

Purity: 98%

Ref: 54-OR1077117

3a-Hydroxy-7-Oxocholanoyltaurine

CAS: 75808-01-4

Formula: C₂₆H₄₃NO₆S

Molecular weight: 497.69

Ref: 4Z-T-444007

3α-Hydroxy-7-oxocholanoyltaurine

Controlled Product

CAS: 75808-01-4

Applications 7-Ketolithocholic Acid-taurine Conjugate is a bile acid conjugate and metabolite of Taurolithocholic Acid (T009100) with antiinflammatory activity. Taurochenodeoxycholic Acid has been shown to inhibit hepatocyte apoptosis through suppression of Bid translocation to mitochondria.
References Emerman, S. et al.: J. Biol. Chem., 242, 661 (1967); Takikawa, Y. et al.: Falk Symp., 120, 249 (2001); Li, P. et al.: Zhong. Shour. Xue., 28, 1317 (2008);

Formula: C₂₆H₄₃NO₆S

Color and Shape: Neat

Molecular weight: 497.688

Ref: TR-K175030