Chenodeoxycholic Acid 24-Acyl-β-D-glucuronide

CAS: 208038-27-1

Ref. TR-C291910

Product Information

• Name: Chenodeoxycholic Acid 24-Acyl-β-D-glucuronide
• Synonyms: 1-[(3α,5β,7α)-3,7-Dihydroxycholan-24-oate] β-D-Glucopyranuronic Acid
• Brand: TRC
• Description: Applications Chenodeoxycholic Acid 24-Acyl-β-D-glucuronide is a glucuronide metabolite of Chenodeoxycholic Acid (CDCA) (C291900).References Alme, B., et al.: J. Steroid Biochem., 13, 907 (1980), Goto, J., et al.: Steroids, 63, 186 (1998), Barbier, O., et al.: J. Steroid Biochem. Mol. Biol., 85, 235 (2003),

Chemical properties

• Molecular weight: 568.7
• Formula: C₃₀H₄₈O₁₀
• Color/Form: Neat
• InChI: InChI=1S/C30H48O10/c1-14(4-7-21(33)39-28-25(36)23(34)24(35)26(40-28)27(37)38)17-5-6-18-22-19(9-11-30(17,18)3)29(2)10-8-16(31)12-15(29)13-20(22)32/h14-20,22-26,28,31-32,34-36H,4-13H2,1-3H3,(H,37,38)/t14-,15+,16-,17-,18+,19+,20-,22+,23+,24+,25-,26+,28-,29+,30-/m1/s1
• InChI key: InChIKey=ZTJBLIAPAIPNJE-BWGRGVIUSA-N
• SMILES: C[C@H](CCC(=O)O[C@@H]1O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]1O)[C@H]1CC[C@H]2[C@H]3[C@H](CC[C@@]21C)[C@@]1(C)CC[C@@H](O)C[C@H]1C[C@H]3O