Crystallography Open Database

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7157837 CIFC24 H25 Br N2 O5P 21 21 214.9355; 9.9998; 44.492
90; 90; 90
2195.9Marshall, James W.; de Mattos-Shipley, Kate M J; Ghannam, Iman A. Y.; Munawar, Asifa; Killen, Jonathan C.; Lazarus, Colin M.; Cox, Russell J.; Willis, Christine L.; Simpson, Thomas J.
Fusarochromene, a novel tryptophan-derived metabolite from <i>Fusarium sacchari</i>.
Organic & biomolecular chemistry, 2021, 19, 182-187
7157838 CIFC22 H18 Br F3 N2 O2P 21 21 216.2936; 14.1248; 23.296
90; 90; 90
2070.92Gao, Yang; Song, Xue; Yan, Ru-Jie; Du, Wei; Chen, Ying-Chun
Asymmetric β,γ'-regioselective [4 + 3] and [4 + 2] annulations of α-vinylenals <i>via</i> cascade iminium ion-dienamine catalysis.
Organic & biomolecular chemistry, 2021, 19, 151-155
7157839 CIFC24 H20 N2 O2 SP 1 21 18.1897; 12.2546; 10.5538
90; 90.193; 90
1059.19Gao, Yang; Song, Xue; Yan, Ru-Jie; Du, Wei; Chen, Ying-Chun
Asymmetric β,γ'-regioselective [4 + 3] and [4 + 2] annulations of α-vinylenals <i>via</i> cascade iminium ion-dienamine catalysis.
Organic & biomolecular chemistry, 2021, 19, 151-155
7157840 CIFC22 H17 N3 OP 1 21/n 14.954; 20.606; 16.56
90; 91.728; 90
1689.7Malasala, Satyaveni; Polomoni, Anusha; Chelli, Sai Manohar; Kar, Swayamsidda; Madhavi, Y. V.; Nanduri, Srinivas
A microwave-assisted copper-mediated tandem approach for fused quinazoline derivatives.
Organic & biomolecular chemistry, 2021, 19, 1854-1859
7157841 CIFC24 H20 Cl N O2P 1 21/c 112.2034; 8.3948; 19.2731
90; 91.4; 90
1973.85P, Rajesh; Almansour, Abdulrahman I.; Arumugam, Natarajan; Yaragorla, Srinivasarao
Calcium-catalyzed formal [3 + 2] annulation of <i>C</i>,<i>N</i>-diacyliminium ions with nucleophilic phenols: a diversity oriented synthesis of 3-aminofurans.
Organic & biomolecular chemistry, 2021, 19, 1060-1065
7157842 CIFC26 H18 Br N3 O2 SP 4110.235; 10.235; 23.295
90; 90; 90
2440.3Wang, Wenyao; Wei, Shiqiang; Bao, Xiaoze; Nawaz, Shah; Qu, Jingping; Wang, Baomin
Enantioselective [3 + 2] annulation of 4-isothiocyanato pyrazolones and alkynyl ketones under organocatalysis.
Organic & biomolecular chemistry, 2021, 19, 1145-1154
7157843 CIFC15 H16 OP 1 21/n 18.9714; 6.6608; 19.405
90; 98.551; 90
1146.7Samser, Shaikh; Biswal, Priyabrata; Meher, Sushanta Kumar; Venkatasubbaiah, Krishnan
Palladium mediated one-pot synthesis of 3-aryl-cyclohexenones and 1,5-diketones from allyl alcohols and aryl ketones.
Organic & biomolecular chemistry, 2021, 19, 1386-1394
7157844 CIFC29 H24 N2 O4 SP -18.3267; 8.7156; 16.902
97.684; 91.3; 94.942
1210.4Wang, Hai-Qing; Ma, Wenjing; Sun, Ao; Sun, Xin-Yue; Jiang, Chao; Zhang, Yu-Chen; Shi, Feng
(4 + 2) cyclization of aza-<i>o</i>-quinone methides with azlactones: construction of biologically important dihydroquinolinone frameworks.
Organic & biomolecular chemistry, 2021, 19, 1334-1343
7157845 CIFC23 H26 N2 O3 S SiP -110.1798; 10.3113; 12.4879
112.371; 101.901; 101.004
1132.33Tsuda, Masato; Morita, Taiki; Fukuhara, Shintaro; Nakamura, Hiroyuki
Synthesis of 4-amino-5-allenylisoxazoles <i>via</i> gold(I)-catalysed propargyl aza-Claisen rearrangement.
Organic & biomolecular chemistry, 2021, 19, 1358-1364
7157846 CIFC27 H32 O7P 1 21 16.1764; 22.3986; 16.9215
90; 94.563; 90
2333.55Chen, Yan-Ni; Ding, Xiao; Li, Dong-Mei; Sun, Mao; Yang, Lei; Zhang, Yu; Di, Ying-Tong; Fang, Xin; Hao, Xiao-Jiang
Diterpenoids with an unprecedented ring system from <i>Euphorbia peplus</i> and their activities in the lysosomal-autophagy pathway.
Organic & biomolecular chemistry, 2021, 19, 1541-1545
7157847 CIFC24 H36 N2 O3 SP 1 21/c 19.65728; 15.7878; 31.1416
90; 93.2577; 90
4740.4Palate, Kleopas Y.; Epton, Ryan G.; Whitwood, Adrian C.; Lynam, Jason M.; Unsworth, William P.
Synthesis of macrocyclic and medium-sized ring thiolactones <i>via</i> the ring expansion of lactams.
Organic & biomolecular chemistry, 2021, 19, 1404-1411
7157848 CIFC15 H27 N O2 SP 1 21/c 19.1158; 9.9322; 34.9595
90; 92.94; 90
3161.07Palate, Kleopas Y.; Epton, Ryan G.; Whitwood, Adrian C.; Lynam, Jason M.; Unsworth, William P.
Synthesis of macrocyclic and medium-sized ring thiolactones <i>via</i> the ring expansion of lactams.
Organic & biomolecular chemistry, 2021, 19, 1404-1411
7157849 CIFC10 H17 N O2 SP b c a8.0303; 9.6259; 27.807
90; 90; 90
2149.45Palate, Kleopas Y.; Epton, Ryan G.; Whitwood, Adrian C.; Lynam, Jason M.; Unsworth, William P.
Synthesis of macrocyclic and medium-sized ring thiolactones <i>via</i> the ring expansion of lactams.
Organic & biomolecular chemistry, 2021, 19, 1404-1411
7157850 CIFC14 H15 N O7P 1 21 14.7659; 12.6787; 11.0168
90; 95.803; 90
662.28Dong, Sanfeng; Zhao, Yitian; Shi, Yulong; Xu, Zhijian; Shen, Jingshan; Jia, Qi; Li, Yiming; Chen, Kaixian; Li, Bo; Zhu, Weiliang
One step stereoselective synthesis of oxazoline-fused saccharides and their conversion into the corresponding 1,2-<i>cis</i> glycosylamines bearing various protected groups.
Organic & biomolecular chemistry, 2021, 19, 1580-1588
7157851 CIFC25 H21 Br O4P 21 21 2110.0294; 10.8154; 19.2909
90; 90; 90
2092.52Xu, Yan-Li; Qin, Zhou-Zhou; Wang, Yu-Xia; Zhao, Peng-Fei; Li, Hong-Feng; Du, Zhi-Hong; Da, Chao-Shan
Highly enantioselective one-pot sequential synthesis of valerolactones and pyrazolones bearing all-carbon quaternary stereocentres.
Organic & biomolecular chemistry, 2021, 19, 1610-1615
7157852 CIFC25 H23 Cl N2 O3P 21 21 217.0441; 16.2447; 18.72
90; 90; 90
2142.12Xu, Yan-Li; Qin, Zhou-Zhou; Wang, Yu-Xia; Zhao, Peng-Fei; Li, Hong-Feng; Du, Zhi-Hong; Da, Chao-Shan
Highly enantioselective one-pot sequential synthesis of valerolactones and pyrazolones bearing all-carbon quaternary stereocentres.
Organic & biomolecular chemistry, 2021, 19, 1610-1615
7157853 CIFC23 H18 O3 SP -18.431; 10.6418; 11.6712
115.047; 104.819; 94.55
895.84Xie, Wucheng; Jian, Xinyi; Zhang, Liyang; Jin, Kexin; Shi, Junjun; Zhu, Feng
Synthesis of C3-sulfone substituted naphthols <i>via</i> rhodium(III)-catalyzed annulation of sulfoxonium ylides with alkynylsulfones.
Organic & biomolecular chemistry, 2021, 19, 1498-1502
7157854 CIFC24 H20 O3 SP -18.1695; 11.1838; 12.1869
116.288; 102.125; 97.876
941.83Xie, Wucheng; Jian, Xinyi; Zhang, Liyang; Jin, Kexin; Shi, Junjun; Zhu, Feng
Synthesis of C3-sulfone substituted naphthols <i>via</i> rhodium(III)-catalyzed annulation of sulfoxonium ylides with alkynylsulfones.
Organic & biomolecular chemistry, 2021, 19, 1498-1502
7157855 CIFC26 H23 Cl N2 O3P 21 21 2110.234; 14.235; 30.529
90; 90; 90
4447Guo, Xing; Chen, Xuling; Cheng, Yuyu; Chang, Xiaoyong; Li, Xuechen; Li, Pengfei
Organocatalytic enantioselective [2 + 4]-annulation of γ-substituted allenoates with <i>N</i>-acyldiazenes for the synthesis of optically active 1,3,4-oxadiazines.
Organic & biomolecular chemistry, 2021, 19, 1727-1731
7157856 CIFC30 H34 N2 O3P 1 21/n 110.6498; 10.95; 21.8176
90; 104.078; 90
2467.85Guo, Xing; Chen, Xuling; Cheng, Yuyu; Chang, Xiaoyong; Li, Xuechen; Li, Pengfei
Organocatalytic enantioselective [2 + 4]-annulation of γ-substituted allenoates with <i>N</i>-acyldiazenes for the synthesis of optically active 1,3,4-oxadiazines.
Organic & biomolecular chemistry, 2021, 19, 1727-1731
7157857 CIFC26 H18 Br N3 O2 SP -110.479; 11.171; 12.25
64.87; 73.59; 66.24
1177.4Babu, Sheba Ann; A R, Rajalekshmi; P R, Nitha; Omanakuttan, Vishnu K.; P, Rahul; Varughese, Sunil; John, Jubi
Unprecedented access to functionalized pyrrolo[2,1-<i>a</i>]isoquinolines from the domino reaction of isoquinolinium ylides and electrophilic benzannulated heterocycles.
Organic & biomolecular chemistry, 2021, 19, 1807-1817
7157858 CIFC50 H32 N2 O2 S2P 1 21/c 115.23; 14.373; 18.32
90; 106.462; 90
3846Babu, Sheba Ann; A R, Rajalekshmi; P R, Nitha; Omanakuttan, Vishnu K.; P, Rahul; Varughese, Sunil; John, Jubi
Unprecedented access to functionalized pyrrolo[2,1-<i>a</i>]isoquinolines from the domino reaction of isoquinolinium ylides and electrophilic benzannulated heterocycles.
Organic & biomolecular chemistry, 2021, 19, 1807-1817
7157859 CIFC14 H14 F14 O14 S14P -111.1078; 14.2349; 14.7424
63.737; 72.36; 82.226
1992.1Zhang, Yuan; Lai, Weiping; Zhang, Lianpeng; Gao, Xiaoxing; Qiu, Guanyinsheng; Zhou, Hongwei
The copper-catalyzed synthesis of (<i>Z</i>)-2<i>H</i>-naphtho[1,8-<i>bc</i>]thiophenes with solid emission.
Organic & biomolecular chemistry, 2021, 19, 1827-1834
7157860 CIFC23 H15 Cl F3 N O3P -17.84; 11.8374; 11.9176
111.955; 97.653; 98.734
991.91Samikannu, Ramesh; Sethuraman, Sankaranarayanan; Akula, Nagaraja; Radhakrishnan, Vignesh; Kamisetti, Srinivasarao; Banu, Shabana; Vetrichelvan, Muthalagu; Gupta, Anuradha; Li, Jianqing; Rampulla, Richard; Mathur, Arvind
Solvent-specific, DAST-mediated intramolecular Friedel-Crafts reaction: access to dibenzoxepine-fused spirooxindoles.
Organic & biomolecular chemistry, 2021, 19, 1760-1768
7157861 CIFC28 H20 O3P -110.3275; 14.0098; 15.4589
90.549; 108.062; 101.778
2075.3Muthusamy, Sengodagounder; Malarvizhi, Muthukumar; Suresh, Eringathodi
Catalyst-free synthesis of 3,1-benzoxathiin-4-ones/1,3-benzodioxin-4-ones.
Organic & biomolecular chemistry, 2021, 19, 1508-1513
7157862 CIFC28 H18 F2 O2 SP 1 21/n 110.2296; 15.605; 14.042
90; 93.949; 90
2236.2Muthusamy, Sengodagounder; Malarvizhi, Muthukumar; Suresh, Eringathodi
Catalyst-free synthesis of 3,1-benzoxathiin-4-ones/1,3-benzodioxin-4-ones.
Organic & biomolecular chemistry, 2021, 19, 1508-1513
7157863 CIFC19 H13 N O5P 4312.4218; 12.4218; 9.8189
90; 90; 90
1515.07Kostenko, Alexey A.; Bykova, Kseniya A.; Kucherenko, Alexander S.; Komogortsev, Andrey N.; Lichitsky, Boris V.; Zlotin, Sergei G.
2-Nitroallyl carbonate-based green bifunctional reagents for catalytic asymmetric annulation reactions.
Organic & biomolecular chemistry, 2021, 19, 1780-1786
7157864 CIFC16 H21 N O3P 1 21/c 113.1376; 14.5412; 15.0949
90; 102.733; 90
2812.8Gao, Weiwei; Wang, Xiaodong; Yao, Linbin; Tang, Bencan; Mu, Guohao; Shi, Tao; Wang, Zhen
Synthesis of an isomer of lycoplanine A <i>via</i> cascade cyclization to construct the spiro-N,O-acetal moiety.
Organic & biomolecular chemistry, 2021, 19, 1748-1751
7157865 CIFC27 H36 N2 O3P 21 21 218.2965; 8.9484; 34.1519
90; 90; 90
2535.45Kimura, Yuto; Uraguchi, Daisuke; Ooi, Takashi
Catalytic asymmetric synthesis of 5-membered alicyclic α-quaternary β-amino acids <i>via</i> [3 + 2]-photocycloaddition of α-substituted acrylates.
Organic & biomolecular chemistry, 2021, 19, 1744-1747
7157866 CIFC13 H11 N3 O2P -17.2529; 12.9297; 13.0243
85.469; 82.621; 73.765
1161.78Agafonova, Anastasiya V.; Funt, Liya D.; Novikov, Mikhail S.; Khlebnikov, Alexander F.
An isoxazole strategy for the synthesis of alkyl 5-amino-4-cyano-1<i>H</i>-pyrrole-2-carboxylates - versatile building blocks for assembling pyrrolo-fused heterocycles.
Organic & biomolecular chemistry, 2021, 19, 1976-1984
7157867 CIFC15 H14 N2 O2 SeP -19.0455; 12.1947; 13.2917
101.367; 90.571; 109.919
1346.68Kumar, Manish; Chhillar, Babli; Yadav, Manisha; Sagar, Poonam; Singhal, Nitin K.; Gates, Paul J.; Butcher, Ray J.; Singh, Vijay P.
Catalytic and highly regenerable aminic organoselenium antioxidants with cytoprotective effects.
Organic & biomolecular chemistry, 2021, 19, 2015-2022
7157868 CIFC26 H21 N3 O SP -18.9364; 10.9906; 12.2832
74.382; 74.161; 69.175
1064.71de Souza, Juliana M.; Abdiaj, Irini; Chen, Jiaqi; Hanson, Kenneth; de Oliveira, Kleber T.; McQuade, D. Tyler
Synthesis of multi-substituted pyridines from ylidenemalononitriles and their emission properties.
Organic & biomolecular chemistry, 2021, 19, 1991-1999
7157869 CIFC25 H19 N3P 1 21/c 15.8187; 23.8383; 13.7274
90; 97.246; 90
1888.89de Souza, Juliana M.; Abdiaj, Irini; Chen, Jiaqi; Hanson, Kenneth; de Oliveira, Kleber T.; McQuade, D. Tyler
Synthesis of multi-substituted pyridines from ylidenemalononitriles and their emission properties.
Organic & biomolecular chemistry, 2021, 19, 1991-1999
7157870 CIFC18 H14 N4P b c a11.3651; 11.1837; 23.1292
90; 90; 90
2939.81de Souza, Juliana M.; Abdiaj, Irini; Chen, Jiaqi; Hanson, Kenneth; de Oliveira, Kleber T.; McQuade, D. Tyler
Synthesis of multi-substituted pyridines from ylidenemalononitriles and their emission properties.
Organic & biomolecular chemistry, 2021, 19, 1991-1999
7157871 CIFC28 H24 Cl2 N6P -17.6769; 12.7598; 13.4914
77.32; 82.364; 74.894
1240.75de Souza, Juliana M.; Abdiaj, Irini; Chen, Jiaqi; Hanson, Kenneth; de Oliveira, Kleber T.; McQuade, D. Tyler
Synthesis of multi-substituted pyridines from ylidenemalononitriles and their emission properties.
Organic & biomolecular chemistry, 2021, 19, 1991-1999
7157872 CIFC16 H14 F3 N3 SP -15.3363; 11.5026; 25.9164
94.122; 94.41; 102.197
1543.92de Souza, Juliana M.; Abdiaj, Irini; Chen, Jiaqi; Hanson, Kenneth; de Oliveira, Kleber T.; McQuade, D. Tyler
Synthesis of multi-substituted pyridines from ylidenemalononitriles and their emission properties.
Organic & biomolecular chemistry, 2021, 19, 1991-1999
7157873 CIFC22 H20 N4 O3 SP 1 21/c 114.1835; 24.2903; 6.0587
90; 92.304; 90
2085.66de Souza, Juliana M.; Abdiaj, Irini; Chen, Jiaqi; Hanson, Kenneth; de Oliveira, Kleber T.; McQuade, D. Tyler
Synthesis of multi-substituted pyridines from ylidenemalononitriles and their emission properties.
Organic & biomolecular chemistry, 2021, 19, 1991-1999
7157874 CIFC18 H16 Br N O2P -18.9145; 9.9325; 10.1186
87.116; 69.183; 70.272
785.82Wang, Yu-Chao; Huang, Keke; Lai, Xiaojing; Shi, Zhongning; Liu, Jin-Biao; Qiu, Guanyinsheng
Radical bromination-induced <i>ipso</i> cyclization-<i>ortho</i> cyclization sequence of <i>N</i>-hydroxylethyl-<i>N</i>-arylpropiolamides.
Organic & biomolecular chemistry, 2021, 19, 1940-1944
7157875 CIFC19 H23 N O3 SP 1 21/c 110.6472; 32.4978; 11.2031
90; 100.67; 90
3809.37Gao, Erhui; Peng, Cheng; Zhang, Jingyi; Wang, Xiao-Na; Chang, Junbiao
Metal-free hydroalkoxylation of ynesulfonamides with esters.
Organic & biomolecular chemistry, 2021, 19, 2182-2185
7157876 CIFC34 H36 N2 O5 S2P b c a12.8604; 17.5424; 28.9789
90; 90; 90
6537.71Gao, Erhui; Peng, Cheng; Zhang, Jingyi; Wang, Xiao-Na; Chang, Junbiao
Metal-free hydroalkoxylation of ynesulfonamides with esters.
Organic & biomolecular chemistry, 2021, 19, 2182-2185
7157877 CIFC37 H22 B F2 N5 OC 1 2/c 127.115; 11.5861; 18.6719
90; 105.101; 90
5663.3Liu, Hui; Xue, Jiaying; Wang, Sisi; Wu, Fan; Zhao, Yue; Shen, Zhen
Thermal switches between delayed fluorescence and persistent phosphorescence based on a keto-BODIPY electron acceptor.
Organic & biomolecular chemistry, 2021, 19, 2030-2037
7157878 CIFC39 H22 B F2 N5 OP -18.939; 9.493; 17.408
88.857; 84.196; 88.477
1469Liu, Hui; Xue, Jiaying; Wang, Sisi; Wu, Fan; Zhao, Yue; Shen, Zhen
Thermal switches between delayed fluorescence and persistent phosphorescence based on a keto-BODIPY electron acceptor.
Organic & biomolecular chemistry, 2021, 19, 2030-2037
7157879 CIFC18 H19 B O2 SP 1 21/c 111.427; 10.282; 13.6992
90; 99.468; 90
1587.6Welsh, Erin N.; Robertson, Katherine N.; Speed, Alexander W. H.
Short syntheses of 1-substituted dibenzothiophene derivatives.
Organic & biomolecular chemistry, 2021, 19, 2000-2007
7157880 CIFC19 H23 N O S2P 21 21 218.626; 9.2018; 22.6467
90; 90; 90
1797.58Welsh, Erin N.; Robertson, Katherine N.; Speed, Alexander W. H.
Short syntheses of 1-substituted dibenzothiophene derivatives.
Organic & biomolecular chemistry, 2021, 19, 2000-2007
7157881 CIFC15 H12 O SP 1 21/c 16.0539; 21.767; 8.6784
90; 97.314; 90
1134.3Welsh, Erin N.; Robertson, Katherine N.; Speed, Alexander W. H.
Short syntheses of 1-substituted dibenzothiophene derivatives.
Organic & biomolecular chemistry, 2021, 19, 2000-2007
7157882 CIFC13 H7 N SP 1 21/c 17.6092; 3.8618; 32.437
90; 96.374; 90
947.3Welsh, Erin N.; Robertson, Katherine N.; Speed, Alexander W. H.
Short syntheses of 1-substituted dibenzothiophene derivatives.
Organic & biomolecular chemistry, 2021, 19, 2000-2007
7157883 CIFC56 H28 F12 O4 S4P -18.2143; 8.2225; 35.165
89.531; 89.289; 78.488
2327.1Welsh, Erin N.; Robertson, Katherine N.; Speed, Alexander W. H.
Short syntheses of 1-substituted dibenzothiophene derivatives.
Organic & biomolecular chemistry, 2021, 19, 2000-2007
7157884 CIFC26 H24 O4P 1 21/c 117.962; 10.2398; 11.0654
90; 93.763; 90
2030.8Chang, Meng-Yang; Tsai, Min-Chen
Synthesis of benzofused cyclobutaoxepanones <i>via</i> intramolecular annulation of <i>o</i>-cinnamyl chalcones.
Organic & biomolecular chemistry, 2021, 19, 2254-2268
7157885 CIFC26 H24 O4P -19.4174; 10.5047; 11.707
92.823; 108.693; 109.839
1015.58Chang, Meng-Yang; Tsai, Min-Chen
Synthesis of benzofused cyclobutaoxepanones <i>via</i> intramolecular annulation of <i>o</i>-cinnamyl chalcones.
Organic & biomolecular chemistry, 2021, 19, 2254-2268
7157886 CIFC26 H24 O4P 1 21/c 113.873; 22.7202; 6.3384
90; 98.843; 90
1974.1Chang, Meng-Yang; Tsai, Min-Chen
Synthesis of benzofused cyclobutaoxepanones <i>via</i> intramolecular annulation of <i>o</i>-cinnamyl chalcones.
Organic & biomolecular chemistry, 2021, 19, 2254-2268

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