3-{(E)-[(13α,16E)-3-hydroxy-17-oxoestra-1(10),2,4-trien-16-ylidene]methyl}benzamide

Base Information

• Chemical Name: 3-{(E)-[(13α,16E)-3-hydroxy-17-oxoestra-1(10),2,4-trien-16-ylidene]methyl}benzamide
• CAS No.: 1401939-09-0
• Molecular Formula: C₂₆H₂₇NO₃
• Molecular Weight: 401.505

Synonyms:3-{(E)-[(13α,16E)-3-hydroxy-17-oxoestra-1(10),2,4-trien-16-ylidene]methyl}benzamide

Chemical Property of 3-{(E)-[(13α,16E)-3-hydroxy-17-oxoestra-1(10),2,4-trien-16-ylidene]methyl}benzamide

Chemical Property:

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Technology Process of 3-{(E)-[(13α,16E)-3-hydroxy-17-oxoestra-1(10),2,4-trien-16-ylidene]methyl}benzamide

There total 2 articles about 3-{(E)-[(13α,16E)-3-hydroxy-17-oxoestra-1(10),2,4-trien-16-ylidene]methyl}benzamide which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 70.0%

3-Cyanobenzaldehyde (24964-64-5) + (13α)-3-hydroxyestra-1(10),2,4-trien-17-one (53-16-7,517-06-6,1225-03-2,4413-09-6,4680-83-5,5285-27-8,15426-98-9,17337-44-9,19973-76-3,35937-97-4,35937-99-6,35938-00-2,94424-34-7,101976-76-5,107910-81-6,474-84-0) → 3-{(E)-[(13α,16E)-3-hydroxy-17-oxoestra-1(10),2,4-trien-16-ylidene]methyl}benzamide (1401939-09-0)

Guidance literature:

With potassium hydroxide; In ethanol; water; at 100 ℃; for 0.5h;

DOI:10.1016/j.jsbmb.2015.10.020

Reference yield: 54.0%

(13α)-3-hydroxyestra-1(10),2,4-trien-17-one (53-16-7,517-06-6,1225-03-2,4413-09-6,4680-83-5,5285-27-8,15426-98-9,17337-44-9,19973-76-3,35937-97-4,35937-99-6,35938-00-2,94424-34-7,101976-76-5,107910-81-6,474-84-0) + 3-carboxamidobenzaldehyde (126534-87-0) → 3-{(E)-[(13α,16E)-3-hydroxy-17-oxoestra-1(10),2,4-trien-16-ylidene]methyl}benzamide (1401939-09-0)

Guidance literature:

(13α)-3-hydroxyestra-1(10),2,4-trien-17-one; 3-carboxamidobenzaldehyde; With potassium hydroxide; In ethanol; water; for 0.5h; Reflux;

With hydrogenchloride; In ethanol; water;

Reference yield:

3-{(E)-[(13α,16E)-3-hydroxy-17-oxoestra-1(10),2,4-trien-16-ylidene]methyl}benzamide (1401939-09-0) → 3-{[(13α)-3-hydroxy-17-oxoestra-1(10),2,4-trien-16-yl]methyl}benzamide (1401939-12-5)

Guidance literature:

With hydrogen; palladium 10% on activated carbon; In methanol; for 48h; Inert atmosphere;

upstream raw materials:

(13α)-3-hydroxyestra-1(10),2,4-trien-17-one

3-carboxamidobenzaldehyde

3-Cyanobenzaldehyde

Downstream raw materials:

3-{[(13α)-3-hydroxy-17-oxoestra-1(10),2,4-trien-16-yl]methyl}benzamide

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