Products 80434-32-8
CAS 80434-32-8 appears in our catalog under these names: 1-beta-Hydroxydeoxycholic Acid, Ursodeoxycholic Acid Impurity 31, Chenodeoxycholic Acid Impurity 13, 1beta-Hydroxydeoxycholic Acid, 1β-Hydroxydeoxycholic acid, 98.00%. Offered by: Chemat Brand, Hubei YoungXin, TRC, MedChemExpress. Available pack sizes: on request, 10mg, 25mg, 50mg, 100mg, 200mg, 10 mg, 1 mg.
1beta-hydroxydeoxycholic acid is a trihydroxy-5beta-cholanic acid in which the three hydroxy groups are located at positions 1beta, 3alpha, and 12alpha. It has a role as a bile acid metabolite and a human urinary metabolite. It is a trihydroxy-5beta-cholanic acid, a 3beta-hydroxy steroid, a 12alpha-hydroxy steroid and a 1-hydroxy steroid.
Source: ChEBI
| Molecular formula | C24H40O5 |
|---|---|
| Molecular weight | 408.6 g/mol |
| IUPAC name | (4R)-4-[(1R,3S,5R,8S,9S,10S,12S,13R,14S,17R)-1,3,12-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 | DAKYVYUAVGJDRK-FPUZENINSA-N |
| SMILES | C[C@H](CCC(=O)O)[C@H]1CC[C@@H]2[C@@]1([C@H](C[C@H]3[C@H]2CC[C@H]4[C@@]3([C@@H](C[C@H](C4)O)O)C)O)C |
Computed by PubChem (NCBI)
Synonyms:
1beta-hydroxydeoxycholic acid, 1beta,3alpha,12alpha-Trihydroxy-5beta-cholan-24-oic Acid, Cholan-24-oic acid, 1,3,12-trihydroxy-, (1beta,3alpha,5beta,12alpha)-, 1beta,3alpha,12alpha-Trihydroxy-5beta-cholanoic acid, 1 beta, 3alpha, 12alpha-Trihydroxy-5beta-cholanoic acid, 1|A-Hydroxydeoxycholic Acid, 1?-Hydroxydeoxycholic Acid, 1beta-Hydroxydeoxycholic Acid-D4 (major), 1b,3a,12a-trihydroxy-5b-cholan-24-oic acid, 1beta-OH-deoxycholic acid