Products 20835-91-0

CAS 20835-91-0 appears in our catalog under these names: Stigmastane-3,5,6-triol, Sitostanetriol. Offered by: Biosynth, MedChemExpress. Available pack sizes: 10mg, 5mg, 1 mg.

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

Stigmastane-3beta,5alpha,6beta-triol is a 3beta-hydroxy steroid that is stigmastane substituted by hydroxy groups at positions 3, 5 and 6 (the 3beta,5alpha,6beta stereoisomer). It has been isolated from the roots of Breynia fruticosa. It has a role as a metabolite and a plant metabolite. It is a triol, a 3beta-hydroxy steroid, a 6beta-hydroxy steroid and a 5alpha-hydroxy steroid. It derives from a hydride of a stigmastane.

Source: ChEBI

Identity
Molecular formulaC29H52O3
Molecular weight448.7 g/mol
IUPAC name(3S,5R,6R,8S,9S,10R,13R,14S,17R)-17-[(2R,5R)-5-ethyl-6-methylheptan-2-yl]-10,13-dimethyl-1,2,3,4,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthrene-3,5,6-triol
InChIKeyVGSSUFQMXBFFTM-METNKUIYSA-N
SMILESCC[C@H](CC[C@@H](C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2C[C@H]([C@@]4([C@@]3(CC[C@@H](C4)O)C)O)O)C)C(C)C

Computed by PubChem (NCBI)