Products 862-53-3

CAS 862-53-3 is the registry number for 3α,7α,12α,26-Tetrahydroxy-5β-cholestane. Offered by: MedChemExpress. Available pack sizes: Get quote.

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

5beta-cholestane-3alpha,7alpha,12alpha,26-tetrol is a 3alpha-hydroxy steroid, a 7alpha-hydroxy steroid, a 12alpha-hydroxy steroid and a 26-hydroxy steroid. It has a role as a mouse metabolite and a human metabolite. It derives from a hydride of a 5beta-cholestane.

Source: ChEBI

Identity
Molecular formulaC27H48O4
Molecular weight436.7 g/mol
IUPAC name(3R,5S,7R,8R,9S,10S,12S,13R,14S,17R)-17-[(2R)-7-hydroxy-6-methylheptan-2-yl]-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthrene-3,7,12-triol
InChIKeyXJZGNVBLVFOSKJ-XZULNKEGSA-N
SMILESC[C@H](CCCC(C)CO)[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)