Products 434-13-9

CAS 434-13-9 appears in our catalog under these names: Lithocholic acid, 95%, Lithocholic Acid (Chenodeoxycholic Acid EP Impurity C, Ursodeoxycholic Acid EP Impurity C), Lithocholic Acid, >95% (HPLC), 3alpha-Hydroxy-5beta-cholan-24-oic Acid (Lithocholic Acid), Lithocholic Acid. Offered by: Combi-blocks, Chemat Brand, TRC, Mikromol, GLPBio. Available pack sizes: 100g, 5g, 25g, 1g, on request, 50mg, 25mg, 10mM (in 1ml dmso).

Structural formula: {0} (CAS {1})

Lithocholic acid is a monohydroxy-5beta-cholanic acid with a alpha-hydroxy substituent at position 3. It is a bile acid obtained from chenodeoxycholic acid by bacterial action. It has a role as a geroprotector, a mouse metabolite and a human metabolite. It is a C24-steroid, a bile acid and a monohydroxy-5beta-cholanic acid. It is a conjugate acid of a lithocholate.

Source: ChEBI

Identity
Molecular formulaC24H40O3
Molecular weight376.6 g/mol
IUPAC name(4R)-4-[(3R,5R,8R,9S,10S,13R,14S,17R)-3-hydroxy-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
InChIKeySMEROWZSTRWXGI-HVATVPOCSA-N
SMILESC[C@H](CCC(=O)O)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC[C@H]4[C@@]3(CC[C@H](C4)O)C)C

Computed by PubChem (NCBI)