Chenodeoxycholic Acid

• Catalog Number: ACM474259
• Product Name: Chenodeoxycholic Acid
• CAS: 474-25-9
• Category: Sterols
• Subcategory: Cholesterols
• Synonyms: Deoxychenocholic acid
• IUPAC Name: (4R)-4-[(3R,5S,7R,8R,9S,10S,13R,14S,17R)-3,7-Dihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoic acid
• Molecular Weight: 392.57
• Molecular Formula: C24H40O4
• Canonical SMILES: CC(CCC(=O)O)C1CCC2C1(CCC3C2C(CC4C3(CCC(C4)O)C)O)C
• InChI: InChI=1S/C24H40O4/c1-14(4-7-21(27)28)17-5-6-18-22-19(9-11-24(17,18)3)23(2)10-8-16(25)12-15(23)13-20(22)26/h14-20,22,25-26H,4-13H2,1-3H3,(H,27,28)/t14-,15+,16-,17-,18+,19+,20-,22+,23+,24-/m1/s1
• InChI Key: RUDATBOHQWOJDD-BSWAIDMHSA-N
• Boiling Point: 437.26 °C
• Melting Point: 165-167 °C(lit.)
• Flash Point: 9 °C
• Purity: 98%
• Density: 0.9985 g/cm³
• Solubility: Practically insoluble in water
• Appearance: White to off-white powder
• Storage: Room temperature
• Exact Mass: 392.29265975
• Physical State: Powder
• Shipping: Gel pack