Cholic Acid Acyl Glucuronide

CAS : 208038-30-6

Ref. TR-A305350

Informations sur le produit

• Nom: Cholic Acid Acyl Glucuronide
• Synonymes: (2S,3S,4S,5R,6S)-3,4,5-Trihydroxy-6-(((R)-4-((3R,5S,7R,8R,9S,10S,12S,13R,14S,17R)-3,7,12-trihydroxy-10,13-dimethylhexadecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanoyl)oxy)tetrahydro-2H-pyran-2-carboxylic Acid, β-D-Glucopyranuronic Acid, 1-[(3α,5β,7α,12α)-3,7,12-Trihydroxycholan-24-oate
• Marque: TRC
• Description: Applications Acyl Glucuronide is a bile acid and steroid conjugate.References Maekawa, M., et al.: Steroids, 80, 80 (2014); Goto, J., et al.: Steroids, 63, 180 (1998); Murao, N., et al.: Chromatography, 19, 276 (1998)

Propriétés chimiques

• Masse moléculaire: 584.696
• Formule: C₃₀H₄₈O₁₁
• Couleur/Forme: Neat
• InChI: InChI=1S/C30H48O11/c1-13(4-7-21(34)40-28-25(37)23(35)24(36)26(41-28)27(38)39)16-5-6-17-22-18(12-20(33)30(16,17)3)29(2)9-8-15(31)10-14(29)11-19(22)32/h13-20,22-26,28,31-33,35-37H,4-12H2,1-3H3,(H,38,39)/t13-,14+,15-,16-,17+,18+,19-,20+,22+,23+,24+,25-,26+,28-,29+,30-/m1/s1
• Code InChI: InChIKey=AIUGVBWFKAVAIZ-SXYQVCRBSA-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](C[C@H](O)[C@@]21C)[C@@]1(C)CC[C@@H](O)C[C@H]1C[C@H]3O