Allocholic Acid

CAS: 2464-18-8

Ref. TR-A545000

Product Information

• Name: Allocholic Acid
• Synonyms: 3-a,7-a,12-a-Trihydroxy-5-a-cholanoic Acid, 5a-Cholic Acid, (3Alpha,5Alpha,7Alpha,12Alpha)-3,7,12-Trihydroxycholan-24-Oic Acid, (3α,5α,7α,12α)-3,7,12-Trihydroxycholan-24-oic acid, 3alpha,7alpha,12alpha-Trihydroxy-5alpha-cholan-24-oic acid, 3α,7α,12α-Trihydroxy-5α-cholanoic acid, 5α-Allocholic acid, 5α-Cholan-24-oic acid, 3α,7α,12α-trihydroxy-, 5α-Cholanic acid, 3α,7α,12α-trihydroxy-, 5α-Cholic acid, Cholan-24-oic acid, 3,7,12-trihydroxy-, (3alpha,5alpha,7alpha,12alpha)-, Cholan-24-oic acid, 3,7,12-trihydroxy-, (3α,5α,7α,12α)-, Nplc 0115, Allocholic acid

Description

Applications Has wide-spread occurrence in a number of sources, including man as a major biliary metabolite.
References Karavolas, H.J., et al.: J. Biol. Chem., 240, 1568 (1965), Tammer, A.R.: Biochem. J., 98, 25 (1966), Eneroth, P., et al.: J. Lipid Res., 7, 524 (1966), Sorensen, P.W., et al.: J. Gen. Physiol., 105, 569 (1995)

• Brand: TRC

Chemical properties

• Molecular weight: 408.57
• Formula: C₂₄H₄₀O₅
• Color/Form: White To Off-White
• InChI: InChI=1S/C24H40O5/c1-13(4-7-21(28)29)16-5-6-17-22-18(12-20(27)24(16,17)3)23(2)9-8-15(25)10-14(23)11-19(22)26/h13-20,22,25-27H,4-12H2,1-3H3,(H,28,29)/t13-,14-,15-,16-,17+,18+,19-,20+,22+,23+,24-/m1/s1
• InChI key: InChIKey=BHQCQFFYRZLCQQ-PGHAKIONSA-N
• SMILES: C[C@H](CCC(=O)O)[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