CAS 2276-93-9

3β-Hydroxy-5α-cholanic acid

Description:

3β-Hydroxy-5α-cholanic acid, also known as cholic acid, is a bile acid that plays a crucial role in the digestion and absorption of dietary fats. It is a steroid molecule characterized by a four-ring carbon structure typical of steroids, with a hydroxyl group at the 3β position and a double bond between carbons 5 and 6. This compound is typically found in the bile of mammals and is synthesized from cholesterol in the liver. Cholic acid is amphipathic, possessing both hydrophilic and hydrophobic properties, which allows it to emulsify fats in the intestine, facilitating their digestion. It is also involved in the regulation of cholesterol levels in the body. The substance has a molecular formula that reflects its steroidal nature, and it can exist in various forms, including its conjugated forms with amino acids like glycine or taurine. Cholic acid is also studied for its potential therapeutic applications, including its role in metabolic disorders and liver health.

Formula: C₂₄H₄₀O₃

InChI: InChI=1S/C24H40O3/c1-15(4-9-22(26)27)19-7-8-20-18-6-5-16-14-17(25)10-12-23(16,2)21(18)11-13-24(19,20)3/h15-21,25H,4-14H2,1-3H3,(H,26,27)/t15-,16+,17+,18+,19-,20+,21+,23+,24-/m1/s1

InChI key: InChIKey=SMEROWZSTRWXGI-XBESLWPFSA-N

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

Synonyms:

• (3Beta,5Alpha)-3-Hydroxycholan-24-Oic Acid
• (3beta,5alpha,17alpha,20S)-3-hydroxycholan-24-oic acid
• (3β,5α)-3-Hydroxycholan-24-oic acid
• 3beta-Hydroxy-5alpha-cholanic acid
• 3β-Hydroxy-5α-cholanic acid
• 3β-Hydroxy-5α-cholanoic acid
• 5α-Cholan-24-oic acid, 3β-hydroxy-
• Alloisolithocholic acid
• Cholan-24-oic acid, 3-hydroxy-, (3beta,5alpha)- (9CI)
• Cholan-24-oic acid, 3-hydroxy-, (3β,5α)-
• Isoallolithocholic acid

Cholan-24-oic acid,3-hydroxy-, (3b,5a)-

CAS: 2276-93-9

Formula: C₂₄H₄₀O₃

Purity: 98%

Color and Shape: Solid

Molecular weight: 376.5726

Ref: IN-DA006WMO

Isoallolithocholic acid

CAS: 2276-93-9

Isoallolithocholic acid

Purity: ≥98%

Molecular weight: 376.57g/mol

Ref: 54-BUP21398

Isoallolithocholic Acid Lithium Salt

CAS: 2276-93-9

Formula: C₂₄H₃₉O₃·Li

Molecular weight: 375.58 6.94

Ref: 4Z-C-5747

Isoallolithocholic acid

CAS: 2276-93-9

Isoallolithocholic acid (3β-Hydroxy-5α-cholanic acid) is a bile acid metabolite and T-cell modulator with anti-inflammatory activity, associated with human immune homeostasis.

Formula: C₂₄H₄₀O₃

Purity: 98% - 99.31%

Color and Shape: Solid

Molecular weight: 376.57

Ref: TM-T36522

Isoallolithocholic Acid

Controlled Product

CAS: 2276-93-9

Applications Isoallolithocholic Acid is used as a steroid compound as T regulatory lymphocyte modulators and uses for treatment of inflammatory or autoimmune disorders.
References Littman, D. R., et al.: PCT Int. Appl. 160pp. (2020)

Formula: C₂₄H₄₀O₃

Color and Shape: White To Off-White

Molecular weight: 376.58

Ref: TR-I267450

5α-Cholanic Acid-3β-ol-23,23-d2

Controlled Product

CAS: 2276-93-9

Formula: C₂₄H₃₈D₂O₃

Color and Shape: Neat

Molecular weight: 378.58

Ref: TR-C693011