Products 6045-53-0

CAS 6045-53-0 appears in our catalog under these names: Estradiol Benzoate Impurity E (17-epi- Estradiol Benzoate), Estradiol Benzoate EP Impurity E, Estradiol Benzoate Impurity 5 (Estradiol Benzoate EP Impurity E), a-Estradiol 3-Benzoate, >95% (HPLC), alpha-Estradiol 3-Benzoate, >95% (HPLC). Offered by: Chemat Brand, Hubei YoungXin, TRC, Mikromol, MedChemExpress. Available pack sizes: on request, 10mg, 25mg, 50mg, 100mg, 200mg, 500mg, Get quote.

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

[(8R,9S,13S,14S,17R)-17-hydroxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-3-yl] benzoate (CAS 6045-53-0) is a chemical compound with the molecular formula C25H28O3 and a molecular weight of 376.5 g/mol. IUPAC name: [(8R,9S,13S,14S,17R)-17-hydroxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-3-yl] benzoate. InChIKey: UYIFTLBWAOGQBI-ABMICEGHSA-N.

Identity
Molecular formulaC25H28O3
Molecular weight376.5 g/mol
IUPAC name[(8R,9S,13S,14S,17R)-17-hydroxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-3-yl] benzoate
InChIKeyUYIFTLBWAOGQBI-ABMICEGHSA-N
SMILESC[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@H]2O)CCC4=C3C=CC(=C4)OC(=O)C5=CC=CC=C5

Computed by PubChem (NCBI)