Products 2464-18-8
CAS 2464-18-8 appears in our catalog under these names: Allocholic Acid, Allocholic Acid, >95% (HPLC), Allocholic acid/ 99.54% (existing batch purity), Allocholic acid, Allocholic Acid, 99%, 99%. Offered by: Chemat Brand, TRC, TargetMol, GLPBio, Biosynth. Available pack sizes: on request, 10mg, 50mg, 5mg, 100mg, 250mg, 500mg, 1000mg.
Allocholic acid is an allo-bile acid that is 5alpha-cholan-24-oic acid bearing three alpha-hydroxy substituents at position 3, 7 and 12. It has a role as a marine metabolite, a human metabolite and a rat metabolite. It is a C24-steroid, an allo-bile acid, a 3alpha-hydroxy steroid, a 7alpha-hydroxy steroid and a 12alpha-hydroxy steroid. It is a conjugate acid of an allocholate.
Source: ChEBI
| Molecular formula | C24H40O5 |
|---|---|
| Molecular weight | 408.6 g/mol |
| IUPAC name | (4R)-4-[(3R,5R,7R,8R,9S,10S,12S,13R,14S,17R)-3,7,12-trihydroxy-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 |
| InChIKey | BHQCQFFYRZLCQQ-PGHAKIONSA-N |
| SMILES | C[C@H](CCC(=O)O)[C@H]1CC[C@@H]2[C@@]1([C@H](C[C@H]3[C@H]2[C@@H](C[C@@H]4[C@@]3(CC[C@H](C4)O)C)O)O)C |
Computed by PubChem (NCBI)
Synonyms:
Allocholic acid, 5alpha-cholic acid, 3alpha,7alpha,12alpha-Trihydroxy-5alpha-cholan-24-oic acid, 3alpha,7alpha,12alpha-Trihydroxy-5alpha-cholanoic acid, 3 alpha,7 alpha,12 alpha-trihydroxy-5 alpha-cholan-24-oic acid, 5a-cholic acid, Cholan-24-oic acid, 3,7,12-trihydroxy-, (3alpha,5alpha,7alpha,12alpha)-, 3-a,7-a,12-a-Trihydroxy-5-a-cholanoic Acid; 5a-Cholic Acid;, 5a-Allocholate, 5a-Cholate