Isoallolithocholic Acid

CAS: 2276-93-9

Ref. TR-I267450

Product Information

• Name: Isoallolithocholic Acid
• Synonyms: (3beta,5alpha)-3-Hydroxycholan-24-oic Acid, 3beta-Hydroxy-5alpha-cholanic Acid, 3beta-Hydroxy-5alpha-cholanoic Acid, NSC 18169, (R)-4-((3S,5S,8R,9S,10S,13R,14S,17R)-3-Hydroxy-10,13-dimethylhexadecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanoic Acid, (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, Nsc 18169

Description

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)

• Brand: TRC

Chemical properties

• Molecular weight: 376.58
• Formula: C₂₄H₄₀O₃
• Color/Form: White To Off-White
• 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@H](CCC(=O)O)[C@H]1CC[C@H]2[C@@H]3CC[C@H]4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@@]21C