Crystallography Open Database

Result : There are 22 entries in the selection

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Searching journal of publication like 'MedChemComm' volume of publication is 3

COD ID: 7112563
CIF file Formula: - C19 H17 N3 O3 -
Comments: Ongarora, Benson G.; Hu, Xiaoke; Li, Hairong; Fronczek, Frank R.; Vicente, M Graça H Syntheses and properties of trimethylaminophenoxy-substituted Zn((II))-phthalocyanines. MedChemComm 3(2) (2012) 179-194
Space group: P 1 21/c 1
Cell volume: 1742.4
Cell parameters: 16.266; 11.114; 9.8401; 90; 101.629; 90;  

COD ID: 7112564
CIF file Formula: - C19 H17 N3 O3 -
Comments: Ongarora, Benson G.; Hu, Xiaoke; Li, Hairong; Fronczek, Frank R.; Vicente, M Graça H Syntheses and properties of trimethylaminophenoxy-substituted Zn((II))-phthalocyanines. MedChemComm 3(2) (2012) 179-194
Space group: P c a 21
Cell volume: 1757
Cell parameters: 10.139; 8.597; 20.157; 90; 90; 90;  

COD ID: 7112565
CIF file Formula: - C30 H30 N4 O6 -
Comments: Ongarora, Benson G.; Hu, Xiaoke; Li, Hairong; Fronczek, Frank R.; Vicente, M Graça H Syntheses and properties of trimethylaminophenoxy-substituted Zn((II))-phthalocyanines. MedChemComm 3(2) (2012) 179-194
Space group: P -1
Cell volume: 1409.38
Cell parameters: 10.0348; 12.0728; 13.3158; 110.46; 102.622; 101.132;  

COD ID: 7112566
CIF file Formula: - C30.4 H18.8 Cl4.8 N4 O2 -
Comments: Ongarora, Benson G.; Hu, Xiaoke; Li, Hairong; Fronczek, Frank R.; Vicente, M Graça H Syntheses and properties of trimethylaminophenoxy-substituted Zn((II))-phthalocyanines. MedChemComm 3(2) (2012) 179-194
Space group: P -1
Cell volume: 1423.75
Cell parameters: 8.9371; 10.3208; 16.1899; 77.863; 81.983; 78.622;  

COD ID: 7112567
CIF file Formula: - C49 H63 Cl N2 O6 Zn -
Comments: Pucci, Daniela; Bellini, Tommaso; Crispini, Alessandra; D'Agnano, Igea; Liguori, Paola F.; Garcia-Orduña, Pilar; Pirillo, Sante; Valentini, Alessandra; Zanchetta, Giuliano DNA binding and cytotoxicity of fluorescent curcumin-based Zn(ii) complexes MedChemComm 3(4) (2012) 462
Space group: P -1
Cell volume: 2312.4
Cell parameters: 9.608; 14.966; 17.648; 112.645; 98.126; 90.686;  

COD ID: 7112568
CIF file Formula: - C13 H21 B F3 P -
Comments: Li, Zibo; Chansaenpak, Kantapat; Liu, Shuanglong; Wade, Casey R.; Conti, Peter S.; Gabbaï, François P. Harvesting 18F-fluoride ions in water via direct 18F‒19F isotopic exchange: radiofluorination of zwitterionic aryltrifluoroborates and in vivo stability studies MedChemComm 3(10) (2012) 1305
Space group: P n a 21
Cell volume: 1446.3
Cell parameters: 11.372; 11.428; 11.129; 90; 90; 90;  

COD ID: 7112569
CIF file Formula: - C21 H19 B F3 O2 P -
Comments: Li, Zibo; Chansaenpak, Kantapat; Liu, Shuanglong; Wade, Casey R.; Conti, Peter S.; Gabbaï, François P. Harvesting 18F-fluoride ions in water via direct 18F‒19F isotopic exchange: radiofluorination of zwitterionic aryltrifluoroborates and in vivo stability studies MedChemComm 3(10) (2012) 1305
Space group: P 1 21/c 1
Cell volume: 1941
Cell parameters: 9.163; 12.426; 17.335; 90; 100.483; 90;  

COD ID: 7112570
CIF file Formula: - C25 H28 O5 -
Comments: Venkatesham, A.; Rao, R. Srinivasa; Nagaiah, K.; Yadav, J. S.; RoopaJones, G.; Basha, S. J.; Sridhar, B.; Addlagatta, A. Synthesis of new chromeno-annulated cis-fused pyrano[3,4-c]pyran derivatives via domino Knoevenagel‒hetero-Diels‒Alder reactions and their biological evaluation towards antiproliferative activity MedChemComm 3(6) (2012) 652
Space group: P 1 21/c 1
Cell volume: 2165.5
Cell parameters: 11.7974; 13.942; 13.4238; 90; 101.254; 90;  

COD ID: 7112571
CIF file Formula: - C22 H22 O5 -
Comments: Venkatesham, A.; Rao, R. Srinivasa; Nagaiah, K.; Yadav, J. S.; RoopaJones, G.; Basha, S. J.; Sridhar, B.; Addlagatta, A. Synthesis of new chromeno-annulated cis-fused pyrano[3,4-c]pyran derivatives via domino Knoevenagel‒hetero-Diels‒Alder reactions and their biological evaluation towards antiproliferative activity MedChemComm 3(6) (2012) 652
Space group: P 1 21/n 1
Cell volume: 1795.3
Cell parameters: 15.4539; 7.4613; 16.2148; 90; 106.214; 90;  

COD ID: 7112572
CIF file Formula: - C28 H28 N2 O2 -
Comments: Mahesh Kumar, P.; Siva Kumar, K.; Meda, Chandana L. T.; Rajeshwar Reddy, G.; Mohakhud, Pradeep K.; Mukkanti, K.; Rama Krishna, G.; Malla Reddy, C.; Rambabu, D.; Shiva Kumar, K.; Krishna Priya, K.; Chennubhotla, Keerthana Sarma; Banote, Rakesh Kumar; Kulkarni, Pushkar; Parsa, Kishore V. L.; Pal, Manojit (Pd/C-mediated)coupling‒iodocyclization‒coupling strategy in discovery of novel PDE4 inhibitors: a new synthesis of pyrazolopyrimidines MedChemComm 3(6) (2012) 667
Space group: P 1 21/c 1
Cell volume: 2423.6
Cell parameters: 15.248; 12.5719; 14.0243; 90; 115.645; 90;  

COD ID: 7112573
CIF file Formula: - C22 H19 I N2 O2 -
Comments: Mahesh Kumar, P.; Siva Kumar, K.; Meda, Chandana L. T.; Rajeshwar Reddy, G.; Mohakhud, Pradeep K.; Mukkanti, K.; Rama Krishna, G.; Malla Reddy, C.; Rambabu, D.; Shiva Kumar, K.; Krishna Priya, K.; Chennubhotla, Keerthana Sarma; Banote, Rakesh Kumar; Kulkarni, Pushkar; Parsa, Kishore V. L.; Pal, Manojit (Pd/C-mediated)coupling‒iodocyclization‒coupling strategy in discovery of novel PDE4 inhibitors: a new synthesis of pyrazolopyrimidines MedChemComm 3(6) (2012) 667
Space group: P 1 21/c 1
Cell volume: 1861.53
Cell parameters: 7.3912; 12.3586; 20.4375; 90; 94.331; 90;  

COD ID: 7112574
CIF file Formula: - C21 H23 N8 O2 -
Comments: Goldberg, Kristin; Groombridge, Sam; Hudson, Julian; Leach, Andrew G.; MacFaul, Philip A.; Pickup, Adrian; Poultney, Ruth; Scott, James S.; Svensson, Per H.; Sweeney, Joseph Oxadiazole isomers: all bioisosteres are not created equal MedChemComm 3(5) (2012) 600
Space group: P -1
Cell volume: 1052.76
Cell parameters: 9.1873; 10.2806; 11.8644; 94.876; 103.767; 102.245;  

COD ID: 7112575
CIF file Formula: - C19 H18 F2 N8 O2 -
Comments: Goldberg, Kristin; Groombridge, Sam; Hudson, Julian; Leach, Andrew G.; MacFaul, Philip A.; Pickup, Adrian; Poultney, Ruth; Scott, James S.; Svensson, Per H.; Sweeney, Joseph Oxadiazole isomers: all bioisosteres are not created equal MedChemComm 3(5) (2012) 600
Space group: P 21 21 21
Cell volume: 1947.6
Cell parameters: 6.8535; 11.759; 24.167; 90; 90; 90;  

COD ID: 7112576
CIF file Formula: - C23 H25 N3 O2 S -
Comments: Lecoutey, Cédric; Rochais, Christophe; Genest, David; Butt-Gueulle, Sabrina; Ballandonne, Céline; Corvaisier, Sophie; Dulin, Fabienne; Lepailleur, Alban; Sopkova-de Oliveira Santos, Jana; Dallemagne, Patrick Synthesis of dual AChE/5-HT4 receptor multi-target directed ligands MedChemComm 3(5) (2012) 627
Space group: P 1 21/c 1
Cell volume: 2024.69
Cell parameters: 18.4455; 5.8641; 20.5004; 90; 114.067; 90;  

COD ID: 7112577
CIF file Formula: - C16 H9 Cl F3 N3 O2 -
Comments: Masciocchi, Daniela; Villa, Stefania; Meneghetti, Fiorella; Pedretti, Alessandro; Barlocco, Daniela; Legnani, Laura; Toma, Lucio; Kwon, Byoung-Mog; Nakano, Shintaro; Asai, Akira; Gelain, Arianna Biological and computational evaluation of an oxadiazole derivative (MD77) as a new lead for direct STAT3 inhibitors MedChemComm 3(5) (2012) 592
Space group: P 1 c 1
Cell volume: 784.9
Cell parameters: 11.115; 5.008; 14.112; 90; 92.28; 90;  

COD ID: 7112578
CIF file Formula: - C29 H32 Cr O5 -
Comments: Saiai, Aroonchai; Bielig, Harald; Velder, Janna; Neudörfl, Jörg-Martin; Menning, Maureen; Kufer, Thomas A.; Schmalz, Hans-Günther Hydrophenalene‒Cr(CO)3 complexes as anti-inflammatory agents based on specific inhibition of NOD2 signalling: a SAR study MedChemComm 3(11) (2012) 1377
Space group: P 1 21/c 1
Cell volume: 2501
Cell parameters: 9.8549; 15.641; 16.5024; 90; 100.507; 90;  

COD ID: 7112579
CIF file Formula: - C29 H31 Cr F O5 -
Comments: Saiai, Aroonchai; Bielig, Harald; Velder, Janna; Neudörfl, Jörg-Martin; Menning, Maureen; Kufer, Thomas A.; Schmalz, Hans-Günther Hydrophenalene‒Cr(CO)3 complexes as anti-inflammatory agents based on specific inhibition of NOD2 signalling: a SAR study MedChemComm 3(11) (2012) 1377
Space group: P -1
Cell volume: 1276.66
Cell parameters: 7.9722; 12.8619; 13.5661; 68.848; 81.683; 81.459;  

COD ID: 7112580
CIF file Formula: - C30 H34 Cr O5 -
Comments: Saiai, Aroonchai; Bielig, Harald; Velder, Janna; Neudörfl, Jörg-Martin; Menning, Maureen; Kufer, Thomas A.; Schmalz, Hans-Günther Hydrophenalene‒Cr(CO)3 complexes as anti-inflammatory agents based on specific inhibition of NOD2 signalling: a SAR study MedChemComm 3(11) (2012) 1377
Space group: P -1
Cell volume: 1296.78
Cell parameters: 8.9498; 11.2208; 13.8926; 90.023; 106.008; 104.171;  

COD ID: 7112581
CIF file Formula: - C30 H31 Cr F3 O5 -
Comments: Saiai, Aroonchai; Bielig, Harald; Velder, Janna; Neudörfl, Jörg-Martin; Menning, Maureen; Kufer, Thomas A.; Schmalz, Hans-Günther Hydrophenalene‒Cr(CO)3 complexes as anti-inflammatory agents based on specific inhibition of NOD2 signalling: a SAR study MedChemComm 3(11) (2012) 1377
Space group: F d d 2
Cell volume: 11028.4
Cell parameters: 32.4358; 34.6; 9.8268; 90; 90; 90;  

COD ID: 7112582
CIF file Formula: - C19 H11 Br Cl2 N2 O4 S -
Comments: Ali, Sher; Saeed, Aamer; Abbas, Naeem; Shahid, Mohammad; Bolte, Michael; Iqbal, Jamshed Design, synthesis and molecular modelling of novel methyl[4-oxo-2-(aroylimino)-3-(substituted phenyl)thiazolidin-5-ylidene]acetates as potent and selective aldose reductase inhibitors MedChemComm 3(11) (2012) 1428
Space group: P -1
Cell volume: 1003.34
Cell parameters: 9.2497; 10.8904; 11.0733; 84.708; 73.497; 69.745;  

COD ID: 7112583
CIF file Formula: - C12 H10 O2 S2 -
Comments: Luo, Yi; Li, Xiaoling; Chen, Tianfeng; Wang, Yi; Zheng, Wenjie Synthesis of a novel thiophene derivative that induces cancer cell apoptosis through modulation of AKT and MAPK pathways MedChemComm 3(9) (2012) 1143
Space group: P 1 21/n 1
Cell volume: 573.66
Cell parameters: 5.6345; 6.2244; 16.3779; 90; 92.902; 90;  

COD ID: 7112584
CIF file Formula: - C21 H27 Fe N3 O2 -
Comments: Spencer, John; Amin, Jahangir; Boddiboyena, Ramesh; Packham, Graham; Cavell, Breeze E.; Syed Alwi, Sharifah S.; Paranal, Ronald M.; Heightman, Tom D.; Wang, Minghua; Marsden, Brian; Coxhead, Peter; Guille, Matthew; Tizzard, Graham J.; Coles, Simon J.; Bradner., James E. Click JAHAs: conformationally restricted ferrocene-based histone deacetylase inhibitors MedChemComm 3(1) (2012) 61
Space group: C 1 2/c 1
Cell volume: 3975.2
Cell parameters: 51.309; 7.2426; 10.7246; 90; 94.098; 90;  


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