Products 1229-25-0

CAS 1229-25-0 appears in our catalog under these names: 6beta-Hydroxy Estrone, 6b-Hydroxy estrone. Offered by: TRC, Biosynth. Available pack sizes: 100mg, 5mg, 10mg, 25mg.

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

6beta-hydroxyestrone is a 3-hydroxy steroid that is estrone substituted by a beta-hydroxy group at position 6. It has a role as a mouse metabolite and a human xenobiotic metabolite. It is a 17-oxo steroid, a member of phenols, a 3-hydroxy steroid and a 6beta-hydroxy steroid. It is functionally related to an estrone. It derives from a hydride of an estrane.

Source: ChEBI

Identity
Molecular formulaC18H22O3
Molecular weight286.4 g/mol
IUPAC name(6R,8R,9S,13S,14S)-3,6-dihydroxy-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-one
InChIKeyHTORTGVWUGQTHQ-UHOVARLQSA-N
SMILESC[C@]12CC[C@H]3[C@H]([C@@H]1CCC2=O)C[C@H](C4=C3C=CC(=C4)O)O

Computed by PubChem (NCBI)