CAS: 76060-22-5 - (3alpha,5beta,7alpha,8xi,12alpha)-7,12,24-trihydroxy-24-oxocholan-3-yl beta-D-glucopyranosiduronic acid

Formula: C₃₀H₄₈O₁₁

InChI: InChI=1S/C30H48O11/c1-13(4-7-21(33)34)16-5-6-17-22-18(12-20(32)30(16,17)3)29(2)9-8-15(10-14(29)11-19(22)31)40-28-25(37)23(35)24(36)26(41-28)27(38)39/h13-20,22-26,28,31-32,35-37H,4-12H2,1-3H3,(H,33,34)(H,38,39)/t13-,14+,15-,16-,17+,18+,19-,20+,22+,23+,24+,25-,26+,28-,29+,30-/m1/s1

InChI key: InChIKey=RBLDVEUUCHVWMW-SXYQVCRBSA-N

SMILES: O=C(O)CCC(C)C1CCC2C3C(O)CC4CC(OC5OC(C(=O)O)C(O)C(O)C5O)CCC4(C)C3CC(O)C12C

Synonyms:

• (3α,5β,7α,12α)-23-Carboxy-7,12-dihydroxy-24-norcholan-3-yl β-<span class="text-smallcaps">D</span>-glucopyranosiduronic acid
• 76060-22-5
• Cholic acid 3-O-glucuronide
• β-<span class="text-smallcaps">D</span>-Glucopyranosiduronic acid, (3α,5β,7α,12α)-23-carboxy-7,12-dihydroxy-24-norcholan-3-yl

Cholic Acid Glucuronide

CAS: 76060-22-5

• Formula: C₃₀H₄₈O₁₁
• Molecular weight: 584.70

Benzyl 3-hydroxyphenylacetate

CAS: 76060-22-5

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• Formula: C₃₀H₄₈O₁₁
• Purity: Min. 95%
• Molecular weight: 584.7 g/mol