Products 3338-16-7
CAS 3338-16-7 appears in our catalog under these names: Ursodeoxycholic Acid Impurity 27, 3beta-Cholic Acid, >95% (HPLC), 3-Beta-Cholic Acid, >95% (HPLC), 3β–Cholic Acid, 3β-Cholic Acid, 98%, 98%. Offered by: Chemat Brand, TRC, GLPBio, Chemat, MedChemExpress. Available pack sizes: on request, 100mg, 50mg, 5mg, 1mg, 10mg, 500μg, 1 mg.
3beta,7alpha,12alpha-trihydroxy-5beta-cholan-24-oic acid is a trihydroxy-5beta-cholanic acid that is 5beta-cholan-24-oic acid substituted by hydroxy groups at positions 3, 7 and 12 (the 3beta,7alpha,12alpha stereoisomer). It has a role as a human metabolite. It is a trihydroxy-5beta-cholanic acid, a bile acid, a 3beta-hydroxy steroid, a 7alpha-hydroxy steroid and a 12alpha-hydroxy steroid. It is a conjugate acid of a 3beta,7alpha,12alpha-trihydroxy-5beta-cholan-24-oate.
Source: ChEBI
| Molecular formula | C24H40O5 |
|---|---|
| Molecular weight | 408.6 g/mol |
| IUPAC name | (4R)-4-[(3S,5S,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-UXWVVXDJSA-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:
isocholic acid, 3beta,7alpha,12alpha-Trihydroxy-5beta-cholan-24-oic Acid, 3beta-cholic acid, 3b-Cholic acid, 3-Epicholic acid, 3|A-Cholic Acid, 3beta,7alpha,12alpha-Trihydroxy-5beta-cholanoic acid, Ursodeoxycholic acid impurity 27, (3beta,5beta,7alpha,12alpha)-3,7,12-trihydroxycholan-24-oic acid, 3-Epicholate