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59960-32-6,MFCD11977834
Catalog No.:AA00EEO9

59960-32-6 | Dihydro Ketoprofen (Mixture of Diastereomers)

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Purity
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Price(USD)
Quantity
  
100mg
97%
in stock  
$33.00   $23.00
- +
250mg
97%
in stock  
$47.00   $33.00
- +
1g
97%
in stock  
$117.00   $82.00
- +
5g
97%
in stock  
$409.00   $287.00
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  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA00EEO9
Chemical Name:
Dihydro Ketoprofen (Mixture of Diastereomers)
CAS Number:
59960-32-6
Molecular Formula:
C16H16O3
Molecular Weight:
256.2964
MDL Number:
MFCD11977834
SMILES:
OC(=O)C(c1cccc(c1)C(c1ccccc1)O)C
Properties
Computed Properties
 
Complexity:
296  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Rotatable Bond Count:
4  
Undefined Atom Stereocenter Count:
2  
XLogP3:
2.8  

Downstream Synthesis Route
84548-82-3    22071-15-4   
α-(3-benzylphenyl)-propionicacid 
  59960-32-6 

[1]Hannoun,Mohammad;Blazevic,Nikola;Kolbah,Dragutin;Mihalic,Mladen;Kajfez,Franjo[JournalofHeterocyclicChemistry,1982,vol.19,p.1131-1136]

[1]Sunjic,Vitomir;Habus,Ivan;Comisso,Giovanni;Moimas,Flavio[GazzettaChimicaItaliana,1989,vol.119,#4,p.229-234]

[1]Bergamaschi,Enrico;Chen,Yi-Kai;Hohenadel,Melissa;Lunic,Danijela;McLean,LiamA.;Teskey,ChristopherJ.[AngewandteChemie-InternationalEdition,2022,vol.61,#8][Angew.Chem.,2022,vol.134,#8]

[2]Ohara,Hirotami;Miyabe,Yoshiyuki;Deyashiki,Yoshihiro;Matsuura,Kazuya;Hara,Akira[BiochemicalPharmacology,1995,vol.50,#2,p.221-227]

[3]Allegretti,Marcello;Bertini,Riccardo;Cesta,MariaCandida;Bizzarri,Cinzia;DiBitondo,Rosa;DiCioccio,Vito;Galliera,Emanuela;Berdini,Valerio;Topai,Alessandra;Zampella,Giuseppe;Russo,Vincenzo;DiBello,Nicoletta;Nano,Giuseppe;Nicolini,Luca;Locati,Massimo;Fantucci,Piercarlo;Florio,Saverio;Colotta,Francesco[JournalofMedicinalChemistry,2005,vol.48,#13,p.4312-4331]

[4]Locationinpatent:experimentalpartSahoo,PrasantaKumar;Behera,Pritishova[EuropeanJournalofMedicinalChemistry,2010,vol.45,#7,p.3162-3168]

[5]Locationinpatent:experimentalpartRajic,Zrinka;Hadjipavlou-Litina,Dimitra;Pontiki,Eleni;Kralj,Marijeta;Suman,Lidija;Zorc,Branka[ChemicalBiologyandDrugDesign,2010,vol.75,#6,p.641-652]

[6]Locationinpatent:experimentalpartRajic,Zrinka;Hadjipavlou-Litina,Dimitra;Pontiki,Eleni;Balzarini,Jan;Zorc,Branka[MedicinalChemistryResearch,2011,vol.20,#2,p.210-219]

[7]Muhammad,Nadeem;Li,Weixia;Subhani,Qamar;Wang,Fenglian;Zhao,Yong-Gang;Zhu,Yan[NewJournalofChemistry,2017,vol.41,#17,p.9321-9329]

[1]Allegretti,Marcello;Bertini,Riccardo;Cesta,MariaCandida;Bizzarri,Cinzia;DiBitondo,Rosa;DiCioccio,Vito;Galliera,Emanuela;Berdini,Valerio;Topai,Alessandra;Zampella,Giuseppe;Russo,Vincenzo;DiBello,Nicoletta;Nano,Giuseppe;Nicolini,Luca;Locati,Massimo;Fantucci,Piercarlo;Florio,Saverio;Colotta,Francesco[JournalofMedicinalChemistry,2005,vol.48,#13,p.4312-4331]

ketoprofenmethylester 
  59960-32-6 

[1]Allegretti,Marcello;Bertini,Riccardo;Cesta,MariaCandida;Bizzarri,Cinzia;DiBitondo,Rosa;DiCioccio,Vito;Galliera,Emanuela;Berdini,Valerio;Topai,Alessandra;Zampella,Giuseppe;Russo,Vincenzo;DiBello,Nicoletta;Nano,Giuseppe;Nicolini,Luca;Locati,Massimo;Fantucci,Piercarlo;Florio,Saverio;Colotta,Francesco[JournalofMedicinalChemistry,2005,vol.48,#13,p.4312-4331]

Literature

Title: Design of noncompetitive interleukin-8 inhibitors acting on CXCR1 and CXCR2.

Journal: Journal of medicinal chemistry 20070823

Title: 2-Arylpropionic CXC chemokine receptor 1 (CXCR1) ligands as novel noncompetitive CXCL8 inhibitors.

Journal: Journal of medicinal chemistry 20050630

Title: Characterization and quantification of metabolites of racemic ketoprofen excreted in urine following oral administration to man by 1H-NMR spectroscopy, directly coupled HPLC-MS and HPLC-NMR, and circular dichroism.

Journal: Xenobiotica; the fate of foreign compounds in biological systems 20040101

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Tags:59960-32-6 Molecular Formula|59960-32-6 MDL|59960-32-6 SMILES|59960-32-6 Dihydro Ketoprofen (Mixture of Diastereomers)