6-Ethylchenodeoxycholic-d5 Acid

CAS: 1992000-80-2

Ref. TR-E899812

Información del producto

• Nombre: 6-Ethylchenodeoxycholic-d5 Acid
• Sinónimos: (3a,5ß,6a,7a)-6-Ethyl-3,7-dihydroxycholan-24-oic Acid-d5, 3a,7ß-Dihydroxy-6a-ethyl-5ß-cholan-24-oic Acid-d5, 6-ECDCA-d5, 6a-Ethylchenodeoxycholic Acid-d5, INT 747-d5, Obeticholic Acid-d5, Ocaliva-d5
• CAS: 1992000-80-2

Descripción

Applications 6-Ethylchenodeoxycholic-d5 Acid is an isotope labelled compound of 6-Ethylchenodeoxycholic Acid (E899810), which is used in the investigative treatment of primary biliary cholangitis. Primary biliary cholangitis is an autoimmune disease of the liver that slowly progresses to cirrhosis.
References Ali, A. H, et al.: Expert Opin. Orphan Drugs, 4, 1011 (2016)

• Marca: TRC

Propiedades químicas

• Peso molecular: 425.66
• Fórmula: C₂₆H₃₉D₅O₄
• Color/Forma: Neat
• InChI: InChI=1S/C26H44O4/c1-5-17-21-14-16(27)10-12-26(21,4)20-11-13-25(3)18(15(2)6-9-22(28)29)7-8-19(25)23(20)24(17)30/h15-21,23-24,27,30H,5-14H2,1-4H3,(H,28,29)/t15-,16-,17-,18-,19+,20+,21+,23+,24-,25-,26-/m1/s1/i1D3,5D2
• Clave InChI: InChIKey=ZXERDUOLZKYMJM-QFCIBDECSA-N
• SMILES: [2H]C([2H])([2H])C([2H])([2H])[C@@H]1[C@@H]2C[C@H](O)CC[C@]2(C)[C@H]2CC[C@@]3(C)[C@@H](CC[C@@H]3[C@H](C)CCC(=O)O)[C@@H]2[C@@H]1O