Crystallography Open Database
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COD ID  |
Links | Formula |
Space group |
Cell parameters | Cell volume  |
Bibliography |
|---|---|---|---|---|---|---|
| 7152130 | CIF | C6 H7 F O3 | P 1 | 5.1716; 5.2806; 6.082 68.403; 67.501; 80.743 | 142.64 | Karban, Jindřich; Císařová, Ivana; Strašák, Tomáš; Šťastná, Lucie Červenková; Sýkora, Jan Skeletal rearrangements resulting from reactions of 1,6:2,3- and 1,6:3,4-dianhydro-β-D-hexopyranoses with diethylaminosulphur trifluoride. Organic & biomolecular chemistry, 2012, 10, 394-403 |
| 7155755 | CIF | C3 Br N | P 1 21/m 1 | 5.095; 6.1734; 6.2035 90; 95.735; 90 | 194.14 | Ligny, Romain; Gauthier, Etienne S.; Yáñez, Manuel; Roisnel, Thierry; Guillemin, Jean-Claude; Trolez, Yann One-step synthesis of conjugated enynenitriles from bromocyanoacetylene. Organic & biomolecular chemistry, 2017 |
| 7157817 | CIF | C8 H10 O4 S2 | P -1 | 5.3453; 6.6576; 6.9904 86.1628; 88.9324; 82.6823 | 246.174 | Ichikawa, Yuki; Hiramatsu, Michiaki; Mita, Yusuke; Makishima, Makoto; Matsumoto, Yotaro; Masumoto, Yui; Muranaka, Atsuya; Uchiyama, Masanobu; Hashimoto, Yuichi; Ishikawa, Minoru <i>meta</i>-Non-flat substituents: a novel molecular design to improve aqueous solubility in small molecule drug discovery. Organic & biomolecular chemistry, 2021, 19, 446-456 |
| 7153431 | CIF | C9 H15 N O7 S | P 1 | 6.0756; 6.6423; 7.3505 80.5318; 84.2434; 89.0269 | 291.12 | Wyszynski, Filip J.; Thompson, Amber L.; Davis, Benjamin G. Inverted regioselectivity of C-H amination: Unexpected oxidation at beta- rather than gamma-C-H. Organic & biomolecular chemistry, 2010, 8, 4246-4248 |
| 7157750 | CIF | C11 H13 Cl N4 O | P 1 | 4.4944; 5.4263; 12.2978 97.735; 94.192; 92.2 | 296.04 | Zhang, Yanhua; Lin, Yun; Hou, Qianqian; Liu, Xi; Pricl, Sabrina; Peng, Ling; Xia, Yi Novel aryltriazole acyclic C-azanucleosides as anticancer candidates. Organic & biomolecular chemistry, 2020, 18, 9689-9699 |
| 7154784 | CIF | C6 H7 F O2 | P -1 | 5.391; 5.4434; 11.1433 84.283; 78.772; 68.545 | 298.37 | Goh, Yi Ling; Adsool, Vikrant A. Radical fluorination powered expedient synthesis of 3-fluorobicyclo[1.1.1]pentan-1-amine. Organic & biomolecular chemistry, 2015, 13, 11597-11601 |
| 7152121 | CIF | C6 H8 O4 | P 1 21 1 | 6.1357; 5.1847; 9.4064 90; 93.064; 90 | 298.81 | Karban, Jindřich; Císařová, Ivana; Strašák, Tomáš; Šťastná, Lucie Červenková; Sýkora, Jan Skeletal rearrangements resulting from reactions of 1,6:2,3- and 1,6:3,4-dianhydro-β-D-hexopyranoses with diethylaminosulphur trifluoride. Organic & biomolecular chemistry, 2012, 10, 394-403 |
| 7152126 | CIF | C6 H7 F O3 | P 1 21 1 | 6.1181; 7.1297; 6.9272 90; 94.628; 90 | 301.18 | Karban, Jindřich; Císařová, Ivana; Strašák, Tomáš; Šťastná, Lucie Červenková; Sýkora, Jan Skeletal rearrangements resulting from reactions of 1,6:2,3- and 1,6:3,4-dianhydro-β-D-hexopyranoses with diethylaminosulphur trifluoride. Organic & biomolecular chemistry, 2012, 10, 394-403 |
| 7152120 | CIF | C6 H8 O4 | P 1 21 1 | 6.6936; 7.0452; 6.707 90; 99.357; 90 | 312.08 | Karban, Jindřich; Císařová, Ivana; Strašák, Tomáš; Šťastná, Lucie Červenková; Sýkora, Jan Skeletal rearrangements resulting from reactions of 1,6:2,3- and 1,6:3,4-dianhydro-β-D-hexopyranoses with diethylaminosulphur trifluoride. Organic & biomolecular chemistry, 2012, 10, 394-403 |
| 7150420 | CIF | C11 H19 N O4 | P 1 | 5.989; 6.651; 8.661 70.749; 77.415; 86.976 | 317.81 | Sengupta, Anindita; Roy, Rituparna S.; Sabareesh, Varatharajan; Shamala, Narayanaswamy; Balaram, Padmanabhan Aggregation modes in sheets formed by protected beta-amino acids and beta-peptides. Organic & biomolecular chemistry, 2006, 4, 1166-1173 |
| 7157816 | CIF | C7 H4 Br N | C 1 m 1 | 9.4437; 8.5227; 4.0482 90; 91.2214; 90 | 325.749 | Ichikawa, Yuki; Hiramatsu, Michiaki; Mita, Yusuke; Makishima, Makoto; Matsumoto, Yotaro; Masumoto, Yui; Muranaka, Atsuya; Uchiyama, Masanobu; Hashimoto, Yuichi; Ishikawa, Minoru <i>meta</i>-Non-flat substituents: a novel molecular design to improve aqueous solubility in small molecule drug discovery. Organic & biomolecular chemistry, 2021, 19, 446-456 |
| 7158980 | CIF | C12 H13 F3 N2 O5 | P 1 | 4.9797; 6.2209; 11.7288 76.575; 80.995; 77.331 | 342.66 | Sharma, Nagendra K.; Gupta, Manish Kumar New Amino acid, Hybrid Peptides and BODIPY Analogs: Synthesis and Evaluation of 2-Aminotroponyl-L-Alanine (ATA) Derivatives Organic & Biomolecular Chemistry, 2022 |
| 7150867 | CIF | C6 H6 B Br O2 | P -1 | 4.957; 7.056; 10.7572 95.766; 92.219; 96.613 | 371.37 | Filthaus, Matthias; Oppel, Iris M.; Bettinger, Holger F. Supramolecular structures and spontaneous resolution: the case of ortho-substituted phenylboronic acids Organic & Biomolecular Chemistry, 2008, 6, 1201-1207 |
| 7151304 | CIF | C13 H23 N3 O3 | P 1 | 5.8431; 7.9668; 9.1733 114.831; 97.043; 99.449 | 373.43 | Sengupta, Anindita; Aravinda, Subrayashastry; Shamala, Narayanaswamy; Raja, K. Muruga Poopathi; Balaram, Padmanabhan Structural studies of model peptides containing ?-, ?- and ?-amino acids Organic & Biomolecular Chemistry, 2006, 4, 4214 |
| 7152640 | CIF | C7 H12 N2 O2 | P -1 | 5.65; 7.884; 9.777 110.051; 90.33; 109.728 | 381.45 | Ha, Khanh; Monbaliu, Jean-Christophe M; Williams, Byron C.; Pillai, Girinath G.; Ocampo, Charles E.; Zeller, Matthias; Stevens, Christian V.; Katritzky, Alan R. A convenient synthesis of difficult medium-sized cyclic peptides by Staudinger mediated ring-closure. Organic & biomolecular chemistry, 2012, 10, 8055-8058 |
| 7150652 | CIF | C15 H23 N O5 | P 1 | 6.1541; 7.9492; 8.6988 71.93; 70.89; 83 | 382.17 | Mathieson, Jennifer E.; Crawford, James J.; Schmidtmann, Marc; Marquez, Rodolfo Fast and efficient one step synthesis of dienamides Organic & Biomolecular Chemistry, 2009, 7, 2170-2175 |
| 7156507 | CIF | C6 H2 N8 O2 | P 1 21/n 1 | 5.7793; 11.6585; 5.7805 90; 100.28; 90 | 383.23 | Sun, Qi; Li, Xin; Lin, Qiuhan; Lu, Ming Tetracyclic pyrazine-fused furazans as insensitive energetic materials: syntheses, structures, and properties. Organic & biomolecular chemistry, 2018, 16, 8034-8037 |
| 7153691 | CIF | C15 H26 O3 S | P 1 | 5.29; 6.432; 12.429 86.64; 88.36; 65.8 | 385.068 | Carroccia, Laura; Degennaro, Leonardo; Romanazzi, Giuseppe; Cuocci, Corrado; Pisano, Luisa; Luisi, Renzo Straightforward access to 4-membered sulfurated heterocycles: introducing a strategy for the single and double functionalization of thietane 1-oxide. Organic & biomolecular chemistry, 2014, 12, 2180-2184 |
| 7157773 | CIF | C17 H19 N O3 S | P 1 | 5.9286; 8.2863; 8.6201 109.21; 90.208; 103.829 | 386.74 | Yang, Shuang; Chen, Yuhang; Yuan, Zidan; Bu, Feiyu; Jiang, Cheng; Ding, Zhenhua Divergent synthesis of oxazolidines and morpholines <i>via</i> PhI(OAc)<sub>2</sub>-mediated difunctionalization of alkenes. Organic & biomolecular chemistry, 2020, 18, 9873-9882 |
| 7158553 | CIF | C7 H10 O4 | P -1 | 5.2698; 7.5782; 10.1856 100.249; 91.298; 98.547 | 395.33 | BRAIA, Nabila; Merabet-Khelassi, Mounia; TOFFANO, martial; Guillot, Régis; Aribi-Zouioueche, Louisa Access to valuable building blocks by regio-and enantioselective ring-opening of itaconic anhydride using lipase catalysis. Organic & Biomolecular Chemistry, 2022 |
| 7155208 | CIF | C7 H3 Br F N O3 | P 1 21 1 | 4.9191; 6.2146; 13.1151 90; 95.211; 90 | 399.27 | Close, Adam J.; Jones, Rhiannon N.; Ocasio, Cory A.; Kemmitt, Paul; Roe, S. Mark; Spencer, John Elaboration of tetra-orthogonally-substituted aromatic scaffolds towards novel EGFR-kinase inhibitors. Organic & biomolecular chemistry, 2016, 14, 8246-8252 |
| 7153936 | CIF | C10 H6 O4 | P 1 21/c 1 | 6.1142; 12.283; 5.6061 90; 107.7; 90 | 401.09 | Korshin, Edward E.; Leitus, Gregory M.; Bendikov, Michael Convenient access to readily soluble symmetrical dialkyl-substituted α-oligofurans. Organic & biomolecular chemistry, 2014, 12, 6661-6671 |
| 7156136 | CIF | C7 H11 N3 O | P 1 21 1 | 5.5524; 7.337; 9.871 90; 91.581; 90 | 402 | Halder, Joydev; Das, Debabrata; Nanda, Samik A distinctive transformation based diversity oriented synthesis of small ring carbocycles and heterocycles from biocatalytically derived enantiopure α-substituted-β-hydroxyesters. Organic & biomolecular chemistry, 2018, 16, 2549-2575 |
| 7151043 | CIF | C5 H11 Cl N4 O | P 1 21 1 | 5.1589; 10.5387; 7.4162 90; 93.901; 90 | 402.27 | Tan, T. H. Samuel; Worthington, Roberta J.; Pritchard, Robin G.; Morral, Jordi; Micklefield, Jason Homopolymeric pyrrolidine-amide oligonucleotide mimics: Fmoc-synthesis and DNA/RNA binding properties. Organic & biomolecular chemistry, 2007, 5, 239-248 |
| 7150360 | CIF | C5 H5 N9 | P -1 | 5.7327; 7.6069; 10.45 96.967; 104.847; 109.68 | 403.83 | Allan, Robin D.; Greenwood, Jeremy R.; Hambley, Trevor W.; Hanrahan, Jane R.; Hibbs, David E.; Itani, Samia; Tran, Hue W.; Turner, Peter Studies on pyridazine azide cyclisation reactions. Organic & biomolecular chemistry, 2004, 2, 1782-1788 |
| 7150109 | CIF | C5 H11 N O5 S | P -1 | 7.3712; 7.4301; 9.0586 66.362; 87.942; 64.538 | 404.73 | Kenworthy, Martin N.; Taylor, Richard J. K. Tethered aminohydroxylation using acyclic homo-allylic sulfamate esters and sulfonamides as substrates. Organic & biomolecular chemistry, 2005, 3, 603-611 |
| 7154955 | CIF | C8 H7 N3 O2 | P -1 | 5.7205; 7.824; 9.811 72.891; 85.142; 74.695 | 404.78 | Patel, Shyam Sunder; Chandna, Nisha; Kumar, Shreemoyee; Jain, Nidhi I2 mediated synthesis of 5-substituted-3-methyl/benzyl-1,3,4-oxadiazol-2(3H)-ones via sequential condensation/oxidative cyclization and rearrangement. Organic & biomolecular chemistry, 2016, 14, 5683-5689 |
| 7151577 | CIF | C7 H10 N2 O5 | P 1 21 1 | 6.9444; 6.4862; 9.16 90; 99.437; 90 | 407.01 | Vogensen, Stine B.; Greenwood, Jeremy R.; Varming, Annemarie R.; Brehm, Lotte; Pickering, Darryl S.; Nielsen, Birgitte; Liljefors, Tommy; Clausen, Rasmus P.; Johansen, Tommy N.; Krogsgaard-Larsen, Povl A stereochemical anomaly: the cyclised (R)-AMPA analogue (R)-3-hydroxy-4,5,6,7-tetrahydroisoxazolo[5,4-c]pyridine-5-carboxylic acid [(R)-5-HPCA] resembles (S)-AMPA at glutamate receptors. Organic & biomolecular chemistry, 2004, 2, 206-213 |
| 7154066 | CIF | C18 H16 O4 S2 | P -1 | 4.8906; 9.361; 9.693 104.639; 101.792; 100.598 | 407.1 | Atzori, Matteo; Pop, Flavia; Cauchy, Thomas; Mercuri, Maria Laura; Avarvari, Narcis Thiophene-benzoquinones: synthesis, crystal structures and preliminary coordination chemistry of derived anilate ligands. Organic & biomolecular chemistry, 2014, 12, 8752-8763 |
| 7150492 | CIF | C20 H16 N4 O4 | P -1 | 3.842; 9.062; 12.098 87.23; 81.25; 78.18 | 407.41 | Bensemann, Igor; Gdaniec, Maria; Łakomecka, Karina; Milewska, Maria J.; Połoński, Tadeusz Creation of hydrogen bonded 1D networks by co-crystallization of N,N'-bis(2-pyridyl)aryldiamines with dicarboxylic acidsSupramolecular structures formed by 2-aminopyridine derivatives. Part II.5 Organic & Biomolecular Chemistry, 2003, 1, 1425 |
| 7153243 | CIF | C17 H22 O5 S | P 1 | 7.6102; 8.2782; 8.3471 111.026; 99.798; 115.264 | 410.05 | O'Byrne, Aisling; Murray, Cian; Keegan, Dearbhla; Palacio, Carole; Evans, Paul; Morgan, Ben S. The thio-adduct facilitated, enzymatic kinetic resolution of 4-hydroxycyclopentenone and 4-hydroxycyclohexenone. Organic & biomolecular chemistry, 2010, 8, 539-545 |
| 7155013 | CIF | C9 H5 Cl N2 O2 | P -1 | 6.6155; 7.022; 9.6435 82.132; 76.879; 71.863 | 413.54 | Théveau, Laure; Schneider, Cédric; Querolle, Olivier; Meerpoel, Lieven; Levacher, Vincent; Hoarau, Christophe Synthesis and orthogonal functionalization of oxazolo[5',4':4,5]pyrano[2,3-b]pyridine by intra- and intermolecular Pd-catalyzed direct C-H bond heteroarylation. Organic & biomolecular chemistry, 2016, 14, 3459-3468 |
| 7150454 | CIF | C9 H14 O2 | P 1 21 1 | 6.1182; 6.6921; 10.181 90; 94.019; 90 | 415.82 | Amelia García Fraile; David G. Morris; Antonio García Martínez; Santiago de la Moya Cerero; Kenneth W. Muir; Karl S. Ryder; Enrique Teso Vilar Self-recognition and hydrogen bonding by polycyclic bridgehead monoalcohols Org. Biomol. Chem., 2003, 1, 700-704 |
| 7155012 | CIF | C9 H5 Cl N2 O2 | P -1 | 4.6985; 9.6719; 9.8461 111.248; 92.409; 91.899 | 416.09 | Théveau, Laure; Schneider, Cédric; Querolle, Olivier; Meerpoel, Lieven; Levacher, Vincent; Hoarau, Christophe Synthesis and orthogonal functionalization of oxazolo[5',4':4,5]pyrano[2,3-b]pyridine by intra- and intermolecular Pd-catalyzed direct C-H bond heteroarylation. Organic & biomolecular chemistry, 2016, 14, 3459-3468 |
| 7155026 | CIF | C18 H15 Br F3 N O | P 1 | 5.0171; 8.347; 10.439 101.211; 102.192; 91.033 | 418.4 | Ikeda, Kazunori; Futamura, Takashi; Hanakawa, Taisyun; Minakawa, Maki; Kawatsura, Motoi Palladium-catalyzed enantioselective allylic alkylation of trifluoromethyl group substituted racemic and acyclic unsymmetrical 1,3-disubstituted allylic esters with malonate anions. Organic & biomolecular chemistry, 2016, 14, 3501-3505 |
| 7150172 | CIF | C16 H22 N2 O5 | P 1 | 5.108; 5.71; 14.903 79.659; 81.128; 89.62 | 422.4 | Dutt, Anita; Drew, Michael G. B.; Pramanik, Animesh beta-Sheet mediated self-assembly of dipeptides of omega-amino acids and remarkable fibrillation in the solid state. Organic & biomolecular chemistry, 2005, 3, 2250-2254 |
| 7151726 | CIF | C8 H13 N O3 | P 1 21 1 | 6.0046; 6.104; 12.099 90; 103.144; 90 | 431.84 | Franklin, Andrew I.; Bensa, David; Adams, Harry; Coldham, Iain Transannular dipolar cycloaddition as an approach towards the synthesis of the core ring system of the sarain alkaloids. Organic & biomolecular chemistry, 2011, 9, 1901-1907 |
| 7150289 | CIF | C9 H12 Se | P -1 | 7.325; 8.283; 8.758 62.64; 84.18; 67.59 | 434.5 | Ford, Susan; Hofmann, Marco; Morley, Christopher P.; Roberts, John L.; Di Vaira, Massimo Tetramethylcyclopentadienylselenium derivatives. Organic & biomolecular chemistry, 2005, 3, 3990-3995 |
| 7159755 | CIF | C5 H5 O2 | C 1 m 1 | 6.3968; 15.9612; 4.3338 90; 100.453; 90 | 435.14 | Darole, Ratanamala S.; Choudhary, Shailendra Singh; Sharma, Himanshu; Mali, Bhupendra P.; Gopu, Booblan; Vanka, Kumar; Senthilkumar, Beeran Brønsted acid- and Ni(II)-catalyzed C-H oxidation/rearrangement of cyclotriveratrylenes (CTVs) to cyclic and acyclic quinones as potential anti-cancer agents. Organic & biomolecular chemistry, 2024, 22, 1038-1046 |
| 7155484 | CIF | C20 H14 N4 O4 | P -1 | 4.673; 7.018; 13.709 77.037; 86.712; 86.883 | 437 | Matsubara, Ryosuke; Eguchi, Shuhei; Ando, Akihiro; Hayashi, Masahiko Synthesis of alkynyl furoxans. Rare carbon-carbon bond-forming reaction on a furoxan ring. Organic & biomolecular chemistry, 2017, 15, 1965-1969 |
| 7154565 | CIF | C14 H18 N2 S6 | P -1 | 4.4366; 7.095; 14.0927 91.198; 95.948; 97.185 | 437.49 | Le Gal, Y.; Ameline, D.; Bellec, N.; Vacher, A.; Roisnel, T.; Dorcet, V.; Jeannin, O.; Lorcy, D. Efficient routes towards a series of 5,5'-bithiazolidinylidenes as π-electron acceptors. Organic & biomolecular chemistry, 2015, 13, 8479-8486 |
| 7155828 | CIF | C9 H9 N3 O2 | P 1 n 1 | 3.8441; 14.0818; 8.2393 90; 101.091; 90 | 437.68 | Sarkar, Sujan K.; Gatlin, DeVonna M; Das, Anushree; Loftin, Breyinn; Krause, Jeanette; Abe, Manabu; Gudmundsdottir , Anna Laser flash photolysis of nanocrystalline α-azido-p-methoxy-acetophenone Org. Biomol. Chem., 2017 |
| 7157919 | CIF | C7 H13 N3 O3 | P 1 21 1 | 10.14; 4.0229; 10.8744 90; 98.89; 90 | 438.26 | Ptiček, Lucija; Hok, Lucija; Grbčić, Petra; Topić, Filip; Cetina, Mario; Rissanen, Kari; Pavelić, Sandra Kraljević; Vianello, Robert; Racané, Livio Amidino substituted 2-aminophenols: biologically important building blocks for the amidino-functionalization of 2-substituted benzoxazoles. Organic & biomolecular chemistry, 2021, 19, 2784-2793 |
| 7151027 | CIF | C12 H10 O2 | P -1 | 6.589; 7.55; 9.691 97.609; 103.781; 106 | 439.8 | Ramachary, Dhevalapally B.; Reddy, Y. Vijayendar; Kishor, Mamillapalli Multi-catalysis reactions: direct organocatalytic sequential one-pot synthesis of highly functionalized cyclopenta[b]chromen-1-ones Organic & Biomolecular Chemistry, 2008, 6, 4188-4197 |
| 7151929 | CIF | C11 H10 O2 | P -1 | 6.352; 7.033; 10.437 83.301; 77.06; 77.613 | 442.7 | Nair, Vijay; Sinu, C. R.; Rejithamol, R.; Seetha Lakshmi, K. C.; Suresh, Eringathodi A novel NHC-catalyzed transformation of 2H-chromene-3-carboxaldehydes to 3-methyl-2H-chromen-2-ones. Organic & biomolecular chemistry, 2011, 9, 5511-5514 |
| 7153258 | CIF | C8 H14 N2 O2 | P -1 | 6.9; 7.365; 8.819 83.78; 86.06; 84.78 | 442.9 | Thiverny, Maryse; Philouze, Christian; Chavant, Pierre Yves; Blandin, Véronique MiPNO, a new chiral cyclic nitrone for enantioselective amino acid synthesis: the cycloaddition approach. Organic & biomolecular chemistry, 2010, 8, 864-872 |
| 7159825 | CIF | C1.54 H1.38 N0.46 | P -1 | 6.3402; 7.4033; 10.8259 102.832; 92.959; 114.223 | 445.98 | Pal, Koustav; Srinivasu, Vinjamuri; Biswas, Sourabh; Sureshkumar, Devarajulu Visible light-induced organo-photocatalyzed route to synthesize substituted pyrazoles. Organic & biomolecular chemistry, 2024, 22, 2384-2388 |
| 7152008 | CIF | C10 H11 N O2 | P 1 21 1 | 8.4105; 5.6321; 10.022 90; 107.78; 90 | 452.05 | Devi, Rema B.; Henrot, Matthias; De Paolis, Michaël; Maddaluno, Jacques Domino alkylation/oxa-Michael of 1,3-cyclohexanediones: Steering the C/O-chemoselectivity to reach tetrahydrobenzofuranones. Organic & biomolecular chemistry, 2011, 9, 6509-6512 |
| 7150888 | CIF | C19 H24 N4 O2 | P 1 | 4.675; 9.497; 10.809 76.78; 81.59; 77.55 | 453.8 | Fischer, Lucile; Didierjean, Claude; Jolibois, Franck; Semetey, Vincent; Manuel Lozano, Jose; Briand, Jean-Paul; Marraud, Michel; Poteau, Romuald; Guichard, Gilles Propensity for local folding induced by the urea fragment in short-chain oligomers Organic & Biomolecular Chemistry, 2008, 6, 2596-2610 |
| 7153666 | CIF | C10 H10 Cl2 | P 1 21 1 | 7.4192; 7.6708; 8.1477 90; 101.304; 90 | 454.7 | Boyd, Derek R.; Sharma, Narain D.; Kaik, Magdalena; McIntyre, Peter B. A.; Malone, John F.; Stevenson, Paul J. Reactions of enantiopure cyclic diols with sulfuryl chloride. Organic & biomolecular chemistry, 2014, 12, 2128-2136 |
| 7150875 | CIF | C9 H6 N2 O5 | P -1 | 5.35; 8.79; 10.58 111.47; 94.77; 94.31 | 458.412 | Mahiout, Zahia; Lomberget, Thierry; Goncalves, Sylvie; Barret, Roland Solvent-dependent oxidations of 5- and 6-azaindoles to trioxopyrrolopyridines and functionalised azaindoles Organic & Biomolecular Chemistry, 2008, 6, 1364-1376 |
| 7153060 | CIF | C22 H20 N2 O3 | P 1 | 7.3566; 8.0059; 9.006 65.624; 71.772; 81.292 | 458.74 | Hardman, Andrea M.; So, Sonia S.; Mattson, Anita E. Urea-catalyzed construction of oxazinanes. Organic & biomolecular chemistry, 2013, 11, 5793-5797 |
| 7159466 | CIF | C9 H10 Br O3 | P 1 21 1 | 7.6869; 5.978; 10.041 90; 95.575; 90 | 459.224 | Ding, Xiao-Bo; Wung, Alexander; Furkert, Daniel P.; Brimble, Margaret A. Synthesis of the spiroimine fragment of portimines A and B. Organic & biomolecular chemistry, 2023, 21, 6008-6017 |
| 7156524 | CIF | C8 H6 Cl2 O2 S | P -1 | 4.9268; 7.7; 12.5316 89.531; 82.298; 77.518 | 459.87 | Hoffmann, Kerstin; Mayer, Peter; Dube, Henry A hemithioindigo molecular motor for metal surface attachment. Organic & biomolecular chemistry, 2019, 17, 1979-1983 |
| 7159925 | CIF | C9 H12 O4 | P 1 | 5.5136; 7.5778; 11.5822 78.459; 82.801; 77.467 | 461.13 | Li, Xiao-Dong; Li, Xiao-Ming; Wang, Bin-Gui; Li, Xin Antimicrobial sesterterpenoids with a unique 5/8/6/5 tetracyclic carbon-ring-system and diepoxide polyketides from a deep sea-sediment-sourced fungus Chaetomium globosum SD-347 Organic & Biomolecular Chemistry, 2024 |
| 7157828 | CIF | C9 H11 N O5 | P 1 21 1 | 8.3; 6.2591; 9.34 90; 108.02; 90 | 461.42 | Lumbroso, Alexandre; Berthonneau, Clément; Beaudet, Isabelle; Quintard, Jean-Paul; Planchat, Aurélien; García-Moreno, M Isabel; Ortiz Mellet, Carmen; Le Grognec, Erwan A versatile stereocontrolled synthesis of 2-deoxyiminosugar C-glycosides and their evaluation as glycosidase inhibitors. Organic & biomolecular chemistry, 2021, 19, 1083-1099 |
| 7157940 | CIF | C10 H10 Cl N O | P 1 21 1 | 5.1792; 13.1666; 6.8217 90; 97.057; 90 | 461.664 | Goodwin, Rosemary J.; Blyth, Mitchell T.; Fung, Alfred K. K.; Smith, Leesa M.; Norcott, Philip L.; Tanovic, Sara; Coote, Michelle L.; White, Nicholas G. Simple acyclic molecules containing a single charge-assisted O-H group can recognize anions in acetonitrile : water mixtures. Organic & biomolecular chemistry, 2021, 19, 2794-2803 |
| 7151750 | CIF | C11 H4 F3 N S | P -1 | 7.223; 7.9584; 9.1866 100.979; 97.143; 113.863 | 462.01 | Ponce González, Julia; Edgar, Mark; Elsegood, Mark R. J.; Weaver, George W. Synthesis of fluorinated fused benzofurans and benzothiophenes: Smiles-type rearrangement and cyclisation of perfluoro(het)aryl ethers and sulfides. Organic & biomolecular chemistry, 2011, 9, 2294-2305 |
| 7159899 | CIF | C12 H8 N2 O2 | P 1 21 1 | 3.7249; 9.6327; 12.9466 90; 92.843; 90 | 463.96 | Ohira, Kazuki; Kozuka, Kumpei; Kaneda, Naoki; Yamamoto, Masahiro; Imato, Keiichi; Ooyama, Yousuke Photochromism of phenazine-2,3-diol derivatives through excited state intermolecular proton transfer based on keto–enol tautomerization Organic & Biomolecular Chemistry, 2024 |
| 7159321 | CIF | C11 H12 O3 | P 1 21 1 | 7.0003; 7.5875; 9.1343 90; 106.874; 90 | 464.28 | Ojo, O. Stephen; Hughes, David L.; Richards, Christopher J. An expedient copper-catalysed asymmetric synthesis of γ-lactones and γ-lactams. Application to the synthesis of lucidulactone A. Organic & biomolecular chemistry, 2023, 21, 4144-4149 |
| 7155929 | CIF | C8 H8 Br2 F2 | P 1 21/n 1 | 6.2656; 6.3728; 11.8196 90; 100.172; 90 | 464.53 | Sedenkova, Kseniya N.; Averina, Elena B.; Grishin, Y K.; Kolodjashnaja, Julia V.; Rybakov, Victor B.; Kuznetsova, Tamara S.; Hughes, Audrey; Gomes, Gabriel dos Passos; Alabugin, Igor; Zefirov, Nikolay S. Substituent effects on stereoselectivity of dihalocarbene reactions with cyclohexadiene and on the reactivity of bis-dihalocyclopropanes in electrophilic nitrations on route to pyrimidine N-oxides Org. Biomol. Chem., 2017 |
| 7151181 | CIF | C6 H10 Br O6 | P -1 | 6.239; 7.228; 11.171 85.342; 82.801; 69.105 | 466.56 | Pirinççioğlu, Necmettin; Robinson, James J.; Mahon, Mary F.; Buchanan, J. Grant; Williams, Ian H. Experimental and computational evidence for alpha-lactone intermediates in the addition of aqueous bromine to disodium dimethyl-maleate and -fumarate. Organic & biomolecular chemistry, 2007, 5, 4001-4009 |
| 7153624 | CIF | C11 H8 N2 S | P 1 21 1 | 6.4535; 7.2728; 10.4085 90; 105.814; 90 | 470.03 | Nagaradja, Elisabeth; Chevallier, Floris; Roisnel, Thierry; Dorcet, Vincent; Halauko, Yury S.; Ivashkevich, Oleg A.; Matulis, Vadim E.; Mongin, Florence Deproto-metallation using a mixed lithium-zinc base and computed CH acidity of 1-aryl 1H-benzotriazoles and 1-aryl 1H-indazoles. Organic & biomolecular chemistry, 2014, 12, 1475-1487 |
| 7151791 | CIF | C6 H7 N O6 S2 | P -1 | 7.2877; 8.168; 8.3571 93.74; 107.823; 92.785 | 471.35 | Patel, Bhaven; Carlisle, Julie; Bottle, Steven E.; Hanson, Graeme R.; Kariuki, Benson M.; Male, Louise; McMurtrie, John C.; Spencer, Neil; Grainger, Richard S. In search of a new class of stable nitroxide: synthesis and reactivity of a peri-substituted N,N-bissulfonylhydroxylamine. Organic & biomolecular chemistry, 2011, 9, 2336-2344 |
| 7159032 | CIF | C9 H16 N O2 | P 1 21 1 | 5.9143; 10.376; 7.9856 90; 105.79; 90 | 471.56 | Giannoulis, Angeliki; Ackermann, Katrin; Bogdanov, Alexey; Cordes, David B.; Higgins, Catherine; Ward, Joshua; Slawin, Alexandra M. Z.; Taylor, James E.; Bode, Bela E. Synthesis of mono-nitroxides and of bis-nitroxides with varying electronic through-bond communication. Organic & biomolecular chemistry, 2023, 21, 375-385 |
| 7159035 | CIF | C20 H26 N2 O2 | P -1 | 5.8003; 5.8739; 14.924 89.862; 86.02; 69.143 | 473.87 | Giannoulis, Angeliki; Ackermann, Katrin; Bogdanov, Alexey; Cordes, David B.; Higgins, Catherine; Ward, Joshua; Slawin, Alexandra M. Z.; Taylor, James E.; Bode, Bela E. Synthesis of mono-nitroxides and of bis-nitroxides with varying electronic through-bond communication. Organic & biomolecular chemistry, 2023, 21, 375-385 |
| 7152919 | CIF | C5 H12 Cl F2 N O3 | P 1 21/m 1 | 5.827; 9.2591; 8.8013 90; 90.3; 90 | 474.85 | Pike, Sarah J.; De Poli, Matteo; Zawodny, Wojciech; Raftery, James; Webb, Simon J.; Clayden, Jonathan Diastereotopic fluorine substituents as (19)F NMR probes of screw-sense preference in helical foldamers. Organic & biomolecular chemistry, 2013, 11, 3168-3176 |
| 7159900 | CIF | C12 H8 N2 O2 | P 1 21 1 | 3.7817; 9.718; 12.9407 90; 92.15; 90 | 475.24 | Ohira, Kazuki; Kozuka, Kumpei; Kaneda, Naoki; Yamamoto, Masahiro; Imato, Keiichi; Ooyama, Yousuke Photochromism of phenazine-2,3-diol derivatives through excited state intermolecular proton transfer based on keto–enol tautomerization Organic & Biomolecular Chemistry, 2024 |
| 7159173 | CIF | C10 H10 Cl N O2 | P 1 21 1 | 5.5304; 8.5314; 10.1412 90; 93.371; 90 | 477.655 | Podrezova, Ekaterina V.; Okhina, Alina A.; Rogachev, Artem D.; Baykov, Sergey V.; Kirschning, Andreas; Yusubov, Mekhman S.; Soldatova, Natalia S.; Postnikov, Pavel S. Ligand-free Ullmann-type arylation of oxazolidinones by diaryliodonium salts. Organic & biomolecular chemistry, 2023, 21, 1952-1957 |
| 7153323 | CIF | C10 H16 O4 | P -1 | 6.28; 7.095; 11.413 97.531; 102.847; 101.348 | 477.9 | Salame, Rim; Gravel, Edmond; Retailleau, Pascal; Poupon, Erwan Biomimetically relevant self-condensations of C5 units derived from lysine. Organic & biomolecular chemistry, 2010, 8, 2522-2528 |
| 7150553 | CIF | C9 H10 N4 O2 | P -1 | 4.5625; 10.2315; 11.4327 107.479; 100.889; 101.507 | 480.82 | Nakaike, Yumi; Hayashi, Daisuke; Nishiwaki, Nagatoshi; Tobe, Yoshito; Ariga, Masahiro Formylnitroenamines: useful building blocks for nitrated pyridones and aminopyridines with functional groups Organic & Biomolecular Chemistry, 2009, 7, 325-334 |
| 7158994 | CIF | C10 H15 F O3 | P 1 21 1 | 7.6334; 5.7702; 11.1406 90; 100.426; 90 | 482.6 | Benckendorff, Caecilie M. M.; Slyusarchuk, Valentyna; Huang, Ningwu; Lima, Marcelo A.; Smith, Mark; Miller, Gavin John Synthesis of fluorinated carbocyclic pyrimidine nucleoside analogues Organic & Biomolecular Chemistry, 2022 |
| 7150365 | CIF | C9 H15 N3 O | P -1 | 7.607; 8.04; 8.369 96.79; 98.36; 104.7 | 483.4 | Reisinger, Ales; Koch, Rainer; Bernhardt, Paul V.; Wentrup, Curt 1H-1,3-diazepines, 5H-1,3-diazepines, 1,3-diazepinones, and 2,4-diazabicyclo[3.2.0]heptenes. Organic & biomolecular chemistry, 2004, 2, 1227-1238 |
| 7154021 | CIF | C11 H12 F N O | P -1 | 6.0469; 9.1864; 9.4011 110.41; 96.98; 92.353 | 483.85 | Cogswell, Thomas J.; Donald, Craig S.; Long, De-Liang; Marquez, Rodolfo Short and efficient synthesis of fluorinated δ-lactams. Organic & biomolecular chemistry, 2015, 13, 717-728 |
| 7158269 | CIF | C10 H14 N4 | P -1 | 7.5321; 8.0983; 9.2836 71.4315; 73.3773; 66.8118 | 484.97 | Al Isawi, Wisam A.; Salome, Austin Z.; Ahmed, Basil M.; Zeller, Matthias; Mezei, Gellert Selective binding of anions by rigidified nanojars: sulfate <i>vs.</i> carbonate. Organic & biomolecular chemistry, 2021, 19, 7641-7654 |
| 7151587 | CIF | C12 H14 O2 | P -1 | 6.6969; 7.0489; 10.9328 77.964; 75.679; 80.977 | 486.04 | Hue, Bui T. B.; Dijkink, Jan; Kuiper, Sanne; Larson, Kimberly K.; Guziec, Jr, Frank S; Goubitz, Kees; Fraanje, Jan; Schenk, Henk; van Maarseveen, Jan H.; Hiemstra, Henk Synthesis of the cyclobutanone core of solanoeclepin A intramolecular allene butenolide photocycloaddition. Organic & biomolecular chemistry, 2003, 1, 4364-4366 |
| 7154635 | CIF | C11 H4 O3 S2 | P 1 21 1 | 3.7349; 10.508; 12.512 90; 96.366; 90 | 488 | Bhuwalka, Achala; Mike, Jared F.; Intemann, Jeremy J.; Ellern, Arkady; Jeffries-El, Malika A versatile and efficient synthesis of bithiophene-based dicarboxaldehydes from a common synthon. Organic & biomolecular chemistry, 2015, 13, 9462-9470 |
| 7158120 | CIF | C9 H9 F3 N2 O2 | P -1 | 4.8119; 10.5336; 10.7314 114.87; 94.157; 90.003 | 491.92 | Kasatkina, Svetlana O.; Geyl, Kirill K.; Baykov, Sergey V.; Boyarskaya, Irina A.; Boyarskiy, Vadim P. Catalyst-free synthesis of substituted pyridin-2-yl, quinolin-2-yl, and isoquinolin-1-yl carbamates from the corresponding hetaryl ureas and alcohols. Organic & biomolecular chemistry, 2021, 19, 6059-6065 |
| 7150033 | CIF | C8 H12 N2 O5 | P -1 | 7.4377; 8.3035; 9.2515 73.265; 67.994; 71.219 | 492.34 | Hibbs, David E.; Overgaard, Jacob; Howard, Siân T; Nguyen, Thanh Ha Experimental charge density of a potential DHO synthetase inhibitor: dimethyl-trans-2-oxohexahydro-pyrimidine-4,6-dicarboxylate. Organic & biomolecular chemistry, 2005, 3, 441-447 |
| 7155913 | CIF | C23 H22 O4 S | P 1 | 5.6715; 8.7531; 10.1807 84.071; 82.036; 83.693 | 495.5 | Przydacz, Artur; Kowalczyk, Rafał; Albrecht, Lukasz Brønsted-base-catalyzed Remote Cascade Reactivity of 2,4-Dienones - Asymmetric Synthesis of Tetrahydrothiophenes Org. Biomol. Chem., 2017 |
| 7151946 | CIF | C9 H6 Br3 N | P -1 | 7.6033; 8.0327; 9.661 68.061; 66.835; 73.873 | 497.24 | Parsons, Thomas B.; Ghellamallah, Cédric; Male, Louise; Spencer, Neil; Grainger, Richard S. Regioselective dibromination of methyl indole-3-carboxylate and application in the synthesis of 5,6-dibromoindoles. Organic & biomolecular chemistry, 2011, 9, 5021-5023 |
| 7152774 | CIF | C11 H15 N O2 | P 1 21 1 | 7.757; 6.483; 9.907 90; 92.808; 90 | 497.6 | Jadhav, Sandip V.; Bandyopadhyay, Anupam; Gopi, Hosahudya N. Protein secondary structure mimetics: crystal conformations of α/γ4-hybrid peptide12-helices with proteinogenic side chains and their analogy with α- and β-peptide helices. Organic & biomolecular chemistry, 2013, 11, 509-514 |
| 7150957 | CIF | C11 H16 O2 | P 1 21 1 | 7.2451; 7.3525; 9.3666 90; 93.255; 90 | 498.15 | Ramachary, Dhevalapally B.; Sakthidevi, Rajasekar Combining multi-catalysis and multi-component systems for the development of one-pot asymmetric reactions: stereoselective synthesis of highly functionalized bicyclo[4.4.0]decane-1,6-diones Organic & Biomolecular Chemistry, 2008, 6, 2488-2492 |
| 7155805 | CIF | C10 H12 B N3 O2 | P 1 c 1 | 8.5138; 5.9254; 10.259 90; 105.511; 90 | 498.69 | Gu, Han; Chio, Tak Ian; Lei, Zhen; Staples, Richard J.; Hirschi, Jennifer S.; Bane, Susan Formation of hydrazones and stabilized boron-nitrogen heterocycles in aqueous solution from carbohydrazides and ortho-formylphenylboronic acids Org. Biomol. Chem., 2017 |
| 7150443 | CIF | C13 H9 N O S | P 1 21 1 | 3.8693; 12.3848; 10.4698 90; 95.015; 90 | 499.8 | Atkinson, Paul; Findlay, Karen S.; Kielar, Filip; Pal, Robert; Parker, David; Poole, Robert A.; Puschmann, Horst; Richardson, Siobhan L.; Stenson, Philip A.; Thompson, Amber L.; Yu, Junhau Azaxanthones and azathioxanthones are effective sensitisers for europium and terbium luminescence. Organic & biomolecular chemistry, 2006, 4, 1707-1722 |
| 7155333 | CIF | C12 H10 N4 | P -1 | 7.5325; 8.2606; 9.0301 73.705; 83.998; 68.21 | 500.78 | Inturi, Surendra Babu; Kalita, Biswajit; Ahamed, A. Jafar I2-TBHP-catalyzed one-pot highly efficient synthesis of 4,3-fused 1,2,4-triazoles from N-tosylhydrazones and aromatic N-heterocycles via intermolecular formal 1,3-dipolar cycloaddition. Organic & biomolecular chemistry, 2016, 14, 11061-11064 |
| 7153661 | CIF | C8 H9 Br N2 O4 | P -1 | 7.3702; 7.6424; 9.3429 95.852; 105.352; 93.753 | 502.48 | Jiang, Jianbing; Vairaprakash, Pothiappan; Reddy, Kanumuri Ramesh; Sahin, Tuba; Pavan, M. Phani; Lubian, Elisa; Lindsey, Jonathan S. Hydrophilic tetracarboxy bacteriochlorins for photonics applications. Organic & biomolecular chemistry, 2014, 12, 86-103 |
| 7151704 | CIF | C10 H5 Br N6 | P -1 | 7.2576; 8.4262; 8.8405 97.305; 110.101; 90.585 | 502.74 | Smith, Catherine J.; Nikbin, Nikzad; Ley, Steven V.; Lange, Heiko; Baxendale, Ian R. A fully automated, multistep flow synthesis of 5-amino-4-cyano-1,2,3-triazoles. Organic & biomolecular chemistry, 2011, 9, 1938-1947 |
| 7152770 | CIF | C9 H11 F N2 O5 | P 1 21 1 | 6.3007; 7.3372; 10.8989 90; 92.277; 90 | 503.45 | Erande, Namrata; Gunjal, Anita D.; Fernandes, Moneesha; Gonnade, Rajesh; Kumar, Vaijayanti A. Synthesis and structural studies of S-type/N-type-locked/frozen nucleoside analogues and their incorporation in RNA-selective, nuclease resistant 2'-5' linked oligonucleotides. Organic & biomolecular chemistry, 2013, 11, 746-757 |
| 7154006 | CIF | C9 H11 I O3 | P -1 | 7.6999; 8.0494; 9.507 104.034; 112.572; 100.066 | 503.71 | Matovic, R.; Bihelovic, F.; Gruden-Pavlovic, M; Saicic, R. N. Total synthesis and biological evaluation of atrop-O-benzyl-desmethylabyssomicin C. Organic & biomolecular chemistry, 2014, 12, 7682-7685 |
| 7150331 | CIF | C8 H14 F2 O5 | P -1 | 6.9777; 8.3569; 9.3808 82.847; 71.23; 77.901 | 505.45 | Audouard, Christophe; Fawcett, John; Griffiths, Gerry A.; Percy, Jonathan M.; Pintat, Stéphane; Smith, Clive A. Synthesis of 4,4-difluoroglycosides using ring-closing metathesis. Organic & biomolecular chemistry, 2004, 2, 528-541 |
| 7150568 | CIF | C12 H12 N4 | P 1 21/c 1 | 9.698; 5.875; 10.023 90; 117.314; 90 | 507.4 | Jiang, Bo; Hao, Wen-Juan; Zhang, Jin-Peng; Tu, Shu-Jiang; Shi, Feng New domino reaction for the selective synthesis of tetracyclic cinnolino[5,4,3-cde]cinnolines Organic & Biomolecular Chemistry, 2009, 7, 1171-1175 |
| 7154705 | CIF | C12 H8 O2 S | P 1 21 1 | 6.1577; 7.3665; 11.253 90; 91.935; 90 | 510.15 | Yohda, Masaaki; Yamamoto, Yasunori Enantioselective addition of arylboronic acids to methyl 2-formylbenzoates by using a ruthenium/Me-BIPAM catalyst for synthesis of chiral 3-aryl-isobenzofuranones. Organic & biomolecular chemistry, 2015, 13, 10874-10880 |
| 7152013 | CIF | C8 H13 N O3 S | P 1 21 1 | 5.1207; 18.0019; 5.8831 90; 109.066; 90 | 512.57 | Aubry, Sylvain; Sasaki, Kaname; Eloy, Laure; Aubert, Geneviève; Retailleau, Pascal; Cresteil, Thierry; Crich, David Exploring the potential of the β-thiolactones in bioorganic chemistry. Organic & biomolecular chemistry, 2011, 9, 7134-7143 |
| 7150493 | CIF | C24 H20 N4 O4 | P -1 | 7.767; 8.8044; 9.1959 62.048; 71.921; 70.707 | 515.1 | Bensemann, Igor; Gdaniec, Maria; Łakomecka, Karina; Milewska, Maria J.; Połoński, Tadeusz Creation of hydrogen bonded 1D networks by co-crystallization of N,N'-bis(2-pyridyl)aryldiamines with dicarboxylic acidsSupramolecular structures formed by 2-aminopyridine derivatives. Part II.5 Organic & Biomolecular Chemistry, 2003, 1, 1425 |
| 7156685 | CIF | C24 H23 Br O3 | P 1 | 5.8561; 8.9674; 10.0618 94.232; 97.739; 98.721 | 515.12 | Khanvilkar, Aditya N.; Samanta, Sudeep G.; Bedekar, Ashutosh V. Applications of chiral naphthyloxycyclohexanols in deracemization of α-substituted carboxylic acids by dynamic thermodynamic resolution. Organic & biomolecular chemistry, 2019, 17, 2670-2683 |
| 7156912 | CIF | C10 H12 N2 O4 | P -1 | 7.6784; 7.8448; 9.1114 91.933; 101.72; 105.491 | 515.61 | Schulze, Daniel; Traber, Juliane; Ritter, Marcel; Görls, Helmar; Pohnert, Georg; Westerhausen, Matthias Total syntheses of the bilirubin oxidation end product Z-BOX C and its isomeric form Z-BOX D. Organic & biomolecular chemistry, 2019, 17, 6489-6496 |
| 7153651 | CIF | C14 H18 O | P -1 | 6.2093; 8.3668; 11.145 74.54; 89.252; 68.175 | 515.65 | Olbrich, Martin; Mayer, Peter; Trauner, Dirk A step toward polytwistane: synthesis and characterization of C2-symmetric tritwistane. Organic & biomolecular chemistry, 2014, 12, 108-112 |
| 7150031 | CIF | C11 H14 O2 S | P 1 21 1 | 7.5387; 6; 11.4544 90; 91.308; 90 | 517.97 | Bedford, Simon T.; Grainger, Richard S.; Steed, Jonathan W.; Tisselli, Patrizia Stereoselective synthesis of 2,5-disubstituted-1,4-oxathiane S-oxides. Organic & biomolecular chemistry, 2005, 3, 404-406 |
| 7155411 | CIF | C11 H8 Br2 | P 1 21 1 | 4.3644; 15.4436; 7.821 90; 99.674; 90 | 519.66 | Lin, Mei-Huey; Chen, Yu-Chun; Chiu, Shih-Hao; Liang, Kung-Yu; Lee, Yi-Lin; Chuang, Tsung-Hsun Stereoselective preparation of conjugated (Z)-1,3-enynes by dehydration reactions of allenic bromohydrins and the use of the enynes in base-mediated tandem allylation ene-carbocyclization reactions with β-ketoesters. Organic & biomolecular chemistry, 2017, 15, 605-609 |
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