Products 1534-35-6

CAS 1534-35-6 appears in our catalog under these names: Isolithocholic Acid, (3beta,5beta)-3-Hydroxycholan-24-oic acid, >95% (HPLC), (3-Beta,5-Beta)-3-Hydroxycholan-24-oic acid, >95% (HPLC), (3b,5b)-3-Hydroxycholan-24-oic acid, >95% (HPLC), Isolithocholic Acid/ 99.4% (existing batch purity). Offered by: Chemat Brand, TRC, TargetMol, GLPBio, Biosynth. Available pack sizes: on request, 100mg, 250mg, 25mg, 1mg, 5mg, 10mg, 50mg.

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

Isolithocholic acid is a monohydroxy-5beta-cholanic acid with a beta-hydroxy substituent at position 3. The 3beta-hydroxy epimer of lithocholic acid. It has a role as a xenobiotic metabolite, a human metabolite and a rat metabolite. It is a C24-steroid, a bile acid, a monohydroxy-5beta-cholanic acid and a 3beta-hydroxy steroid. It is a conjugate acid of an isolithocholate.

Source: ChEBI

Identity
Molecular formulaC24H40O3
Molecular weight376.6 g/mol
IUPAC name(4R)-4-[(3S,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-WFVDQZAMSA-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)