scholarly journals Berichtigung: Strategic Utilization of Multifunctional Carbene for Direct Synthesis of Carboxylic-Phosphinic Mixed Anhydride from CO2

2017 ◽  
Vol 129 (36) ◽  
pp. 10767-10767
Author(s):  
Yoichi Hoshimoto ◽  
Takahiro Asada ◽  
Sunit Hazra ◽  
Takuya Kinoshita ◽  
Panukorn Sombut ◽  
...  
Keyword(s):  
Direct Synthesis ◽  
Mixed Anhydride

scholarly journals Strategic Utilization of Multifunctional Carbene for Direct Synthesis of Carboxylic-Phosphinic Mixed Anhydride from CO2

2016 ◽  
Vol 128 (52) ◽  
pp. 16309-16313 ◽  
Author(s):  
Yoichi Hoshimoto ◽  
Takahiro Asada ◽  
Sunit Hazra ◽  
Takuya Kinoshita ◽  
Panukorn Sombut ◽  
...  
Keyword(s):  
Direct Synthesis ◽  
Mixed Anhydride

scholarly journals Corrigendum: Strategic Utilization of Multifunctional Carbene for Direct Synthesis of Carboxylic-Phosphinic Mixed Anhydride from CO2

2017 ◽  
Vol 56 (36) ◽  
pp. 10631-10631
Author(s):  
Yoichi Hoshimoto ◽  
Takahiro Asada ◽  
Sunit Hazra ◽  
Takuya Kinoshita ◽  
Panukorn Sombut ◽  
...  
Keyword(s):  
Direct Synthesis ◽  
Mixed Anhydride

scholarly journals Strategic Utilization of Multifunctional Carbene for Direct Synthesis of Carboxylic-Phosphinic Mixed Anhydride from CO2

2016 ◽  
Vol 55 (52) ◽  
pp. 16075-16079 ◽  
Author(s):  
Yoichi Hoshimoto ◽  
Takahiro Asada ◽  
Sunit Hazra ◽  
Takuya Kinoshita ◽  
Panukorn Sombut ◽  
...  
Keyword(s):  
Direct Synthesis ◽  
Mixed Anhydride

Structure Guided Molecular Docking Assisted Alignment Dependent 3DQSAR Study on Steroidal Aromatase Inhibitors (SAIs) as Anti-breast Cancer Agents

2019 ◽  
Vol 16 (7) ◽  
pp. 808-817 ◽  
Author(s):  
Laxmi Banjare ◽  
Sant Kumar Verma ◽  
Akhlesh Kumar Jain ◽  
Suresh Thareja
Keyword(s):  
Breast Cancer ◽  
Molecular Docking ◽  
Aromatase Inhibitors ◽  
Direct Synthesis ◽  
3D Qsar ◽  
Chemotherapeutic Agents ◽  
Modeling Tools ◽  
Data Set ◽  
Wide Range ◽  
Steroidal Aromatase Inhibitors

Background: In spite of the availability of various treatment approaches including surgery, radiotherapy, and hormonal therapy, the steroidal aromatase inhibitors (SAIs) play a significant role as chemotherapeutic agents for the treatment of estrogen-dependent breast cancer with the benefit of reduced risk of recurrence. However, due to greater toxicity and side effects associated with currently available anti-breast cancer agents, there is emergent requirement to develop target-specific AIs with safer anti-breast cancer profile. Methods: It is challenging task to design target-specific and less toxic SAIs, though the molecular modeling tools viz. molecular docking simulations and QSAR have been continuing for more than two decades for the fast and efficient designing of novel, selective, potent and safe molecules against various biological targets to fight the number of dreaded diseases/disorders. In order to design novel and selective SAIs, structure guided molecular docking assisted alignment dependent 3D-QSAR studies was performed on a data set comprises of 22 molecules bearing steroidal scaffold with wide range of aromatase inhibitory activity. Results: 3D-QSAR model developed using molecular weighted (MW) extent alignment approach showed good statistical quality and predictive ability when compared to model developed using moments of inertia (MI) alignment approach. Conclusion: The explored binding interactions and generated pharmacophoric features (steric and electrostatic) of steroidal molecules could be exploited for further design, direct synthesis and development of new potential safer SAIs, that can be effective to reduce the mortality and morbidity associated with breast cancer.

α-Ketophosphonates in the Synthesis of α-iminophosphonates

2020 ◽  
Vol 7 (2) ◽  
pp. 226-238
Author(s):  
Petro P. Ony`sko ◽  
Tetyana I. Chudakova ◽  
Vladimir V. Pirozhenko ◽  
Alexandr B. Rozhenko
Keyword(s):  
Bond Cleavage ◽  
Direct Synthesis ◽  
Equilibrium Mixture ◽  
Primary Amines ◽  
Alkyl Amines ◽  
Protic Solvents ◽  
Metallic Salts ◽  
Direct Preparation ◽  
Stage Synthesis ◽  
Aprotic Dipolar Solvent

The potentialities of condensation of α-ketophosphonates with primary amines for direct synthesis of α-iminophosphonates have been revealed. Diesters of α-ketophosphonic acids react with the primary amines by two competitive pathways: with a formation of α-iminophosphonates or a C-P bond cleavage resulting in a hydrogen phosphonate and an acylated amine. In many cases, the latter undesirable pathway is dominant, especially for more nucleophilic alkyl amines. Using metallic salts of α-ketophosphonates avoids the C-P bond cleavage, allowing direct preparation of α-phosphorylated imines by the reaction with primary amines. This strategy provides an atom economy single-stage synthesis of iminophosphonates – precursors of bio relevant phosphorus analogs of α-amino acids. Methyl sodium iminophosphonates, bearing aryl or heteryl substituents at the imino carbon atom exist in solutions at room temperature as an equilibrium mixture of Z- and E-isomers. A configuration of the C=N bond can be controlled by the solvent: changing the aprotic dipolar solvent DMSO-d6 by water or alcohols leads to the change from a predominant Z-isomer to almost an exclusive E-form. In contrast, diesters of the respective iminophosphonates exist in non-protic solvents predominantly in Econfiguration. The solvent effect on E-Z stereochemistry is demonstrated by DFT calculations.

Synthesis of Linear Steroid Oligoesters Based on Etienic Acid

2002 ◽  
Vol 67 (11) ◽  
pp. 1709-1718 ◽  
Author(s):  
Miroslav Reschel ◽  
Miloš Buděšínský ◽  
Ivan Černý ◽  
Vladimír Pouzar ◽  
Pavel Drašar
Keyword(s):  
Carboxylic Acid ◽  
Nmr Spectra ◽  
Mixed Anhydride

Linear oligoesters based on etienic acid (3β-hydroxyandrost-5-ene-17β-carboxylic acid) containing 2-4 steroid units were prepared employing mixed anhydride esterification. NMR spectra of the oligomeric steroids have been fully assigned.

One-pot synthesis of cyclohexylamine and N-aryl pyrroles via hydrogenation of nitroarenes over the Pd0.5Ru0.5-PVP catalyst

2021 ◽  
Author(s):  
Chandan Chaudhari ◽  
Katsutoshi Sato ◽  
Yasuyuki Ikeda ◽  
Kenji Terada ◽  
Naoya Abe ◽  
...  
Keyword(s):  
Direct Synthesis ◽  
One Pot ◽  
One Pot Synthesis

The direct synthesis of cyclohexylamine via hydrogenation of nitrobenzene over monometallic (Pd, Ru or Rh) and bimetallic (PdxRu1−x) catalysts was studied.

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