3α-Hydroxy-5β-cholan-24-oic Acid (Lithocholic Acid)

CAS: 434-13-9

Ref. 86-MM0835.03-0025

Product Information

• Name: 3α-Hydroxy-5β-cholan-24-oic Acid (Lithocholic Acid)
• Synonyms: (3a,5ß)-3-Hydroxycholan-24-oic acid, 17ß-(1-Methyl-3-carboxypropyl)etiocholan-3a-ol, 3-Hydroxycholan-24-oic acid, 3a-Hydroxy-5ß-cholan-24-oate, 3a-Hydroxy-5ß-cholan-24-oic acid, 3a-Hydroxy-5ß-cholanic acid, 3a-Hydroxy-5ß-cholanoic acid, 3a-Hydroxycholanic acid, Lithocholic acid, NSC 683770, Chenodeoxycholic Acid Impurity C, Ursodeoxycholic Acid Impurity C, (3α,5β)-3-Hydroxycholan-24-oic acid, 17β-(1-Methyl-3-carboxypropyl)etiocholan-3α-ol, 3α-Hydroxy-5β-cholan-24-oate, 3α-Hydroxy-5β-cholan-24-oic acid, 3α-Hydroxy-5β-cholanic acid, 3α-Hydroxy-5β-cholanoic acid, 3α-Hydroxycholanic acid, 5β-Cholan-24-oic acid, 3α-hydroxy-, 5β-Cholanic acid, 3α-hydroxy-, Acide lithocholique, Acido Litocolico, Lithocholic Acid, Lithocholsaure, Nsc 683770
• Brand: Mikromol

Chemical properties

• Molecular weight: 376.57
• Formula: C₂₄H₄₀O₃
• Color/Form: Neat
• 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-HVATVPOCSA-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