3-O-Benzyl estrone

For Research Use Only.
Category
Impurities
Cat.No.
NP3576
CAS
858-98-0
Product Name
3-O-Benzyl estrone
Structure

Product Details

Synonyms
3-(Phenylmethoxy)-estra-1,3,5(10)-trien-17-one; 3-(Benzyloxy)-estra-1,3,5(10)-trien-17-one; 3-(Benzyloxy)estra-1,3,5(10)-trien-17-one; 3-Benzyloxyestra-1,3,5(10)triene-17-one; 3-O-Benzylestrone; BLE 99049; Estrone 3-Benzyl Ether; Estrone Benzyl Ether;
IUPAC Name
(8R,9S,13S,14S)-13-methyl-3-phenylmethoxy-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-one
Molecular Weight
360.49
Molecular Formula
C25H28O2
Canonical SMILES
CC12CCC3C(C1CCC2=O)CCC4=C3C=CC(=C4)OCC5=CC=CC=C5
InChI
InChI=1S/C25H28O2/c1-25-14-13-21-20-10-8-19(27-16-17-5-3-2-4-6-17)15-18(20)7-9-22(21)23(25)11-12-24(25)26/h2-6,8,10,15,21-23H,7,9,11-14,16H2,1H3/t21-,22-,23+,25+/m1/s1
InChIKey
MSINETGATWEUAB-AHCIIZGASA-N
Purity
98.0%
Appearance
White Solid
Application
Protected Estrone
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