Crystallography Open Database

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7151658 CIFC24 H29 N O4P 1 21/n 110.881; 17.932; 11.015
90; 104.754; 90
2078Ramesh, Veera V. E.; Roy, Arup; Vijayadas, Kuruppanthara N.; Kendhale, Amol M.; Prabhakaran, Panchami; Gonnade, Rajesh; Puranik, Vedavati G.; Sanjayan, Gangadhar J.
Conformationally rigid aromatic amino acids as potential building blocks for abiotic foldamers.
Organic & biomolecular chemistry, 2011, 9, 367-369
7151659 CIFC21 H14 N2 O7P b c a11.8387; 16.585; 19.535
90; 90; 90
3835.6Ramesh, Veera V. E.; Roy, Arup; Vijayadas, Kuruppanthara N.; Kendhale, Amol M.; Prabhakaran, Panchami; Gonnade, Rajesh; Puranik, Vedavati G.; Sanjayan, Gangadhar J.
Conformationally rigid aromatic amino acids as potential building blocks for abiotic foldamers.
Organic & biomolecular chemistry, 2011, 9, 367-369
7151660 CIFC96 H96 N16 O24P -112.27; 19.6334; 20.4221
75.23; 72.675; 75.364
4457.3Helttunen, Kaisa; Nauha, Elisa; Kurronen, Anni; Shahgaldian, Patrick; Nissinen, Maija
Conformational polymorphism and amphiphilic properties of resorcinarene octapodands.
Organic & biomolecular chemistry, 2011, 9, 906-914
7151661 CIFC99 H102 N16 O25P -111.8003; 20.6248; 21.2868
110.363; 97.492; 99.82
4683.8Helttunen, Kaisa; Nauha, Elisa; Kurronen, Anni; Shahgaldian, Patrick; Nissinen, Maija
Conformational polymorphism and amphiphilic properties of resorcinarene octapodands.
Organic & biomolecular chemistry, 2011, 9, 906-914
7151662 CIFC103 H110 N16 O25P -111.1398; 22.0112; 22.5117
113.189; 100.427; 99.965
4804.5Helttunen, Kaisa; Nauha, Elisa; Kurronen, Anni; Shahgaldian, Patrick; Nissinen, Maija
Conformational polymorphism and amphiphilic properties of resorcinarene octapodands.
Organic & biomolecular chemistry, 2011, 9, 906-914
7151663 CIFC103 H110 N16 O25P -111.8347; 20.5903; 22.5132
113.258; 95.992; 100.282
4865.6Helttunen, Kaisa; Nauha, Elisa; Kurronen, Anni; Shahgaldian, Patrick; Nissinen, Maija
Conformational polymorphism and amphiphilic properties of resorcinarene octapodands.
Organic & biomolecular chemistry, 2011, 9, 906-914
7151664 CIFC100 H104 N16 O24P -111.9965; 20.2594; 22.8564
114.695; 96.967; 99.77
4857.9Helttunen, Kaisa; Nauha, Elisa; Kurronen, Anni; Shahgaldian, Patrick; Nissinen, Maija
Conformational polymorphism and amphiphilic properties of resorcinarene octapodands.
Organic & biomolecular chemistry, 2011, 9, 906-914
7151665 CIFC102 H107 N17 O24P -112.0137; 20.275; 22.8339
115.072; 96.578; 99.681
4857.3Helttunen, Kaisa; Nauha, Elisa; Kurronen, Anni; Shahgaldian, Patrick; Nissinen, Maija
Conformational polymorphism and amphiphilic properties of resorcinarene octapodands.
Organic & biomolecular chemistry, 2011, 9, 906-914
7151666 CIFC132 H163 N16 O25.5P -112.6739; 20.5874; 25.8506
77.841; 77.976; 74.025
6257.4Helttunen, Kaisa; Nauha, Elisa; Kurronen, Anni; Shahgaldian, Patrick; Nissinen, Maija
Conformational polymorphism and amphiphilic properties of resorcinarene octapodands.
Organic & biomolecular chemistry, 2011, 9, 906-914
7151667 CIFC16 H10 Cl2 N2 O2P -17.753; 8.285; 11.93
84.628; 76.938; 84.323
740.8Crespo, Abel; Coelho, Alberto; Diz, Paula M.; Fernández, Franco; Novoa de Armas, Hector; Sotelo, Eddy
Convergent assembly of structurally diverse quinazolines.
Organic & biomolecular chemistry, 2011, 9, 351-357
7151668 CIFC56 H60 F12 N2 O10 P2P 1 21/c 112.789; 26.622; 20.717
90; 127.862; 90
5569Xu, Zhikai; Jiang, Lasheng; Feng, Yahui; Zhang, Suhui; Liang, Jidong; Pan, Shaowu; Yang, Yu; Yang, Dengke; Cai, Yuepeng
One-pot synthesis of donor-acceptor [2]rotaxanes based on cryptand-paraquat recognition motif.
Organic & biomolecular chemistry, 2011, 9, 1237-1243
7151669 CIFC56 H68 F12 N2 O10 P2P -113.672; 14.541; 16.402
112.152; 92.063; 104.255
2897Xu, Zhikai; Jiang, Lasheng; Feng, Yahui; Zhang, Suhui; Liang, Jidong; Pan, Shaowu; Yang, Yu; Yang, Dengke; Cai, Yuepeng
One-pot synthesis of donor-acceptor [2]rotaxanes based on cryptand-paraquat recognition motif.
Organic & biomolecular chemistry, 2011, 9, 1237-1243
7151670 CIFC72 H94 F12 N2 O11 P2P 1 21/c 113.677; 17.347; 34.994
90; 106.807; 90
7948Xu, Zhikai; Jiang, Lasheng; Feng, Yahui; Zhang, Suhui; Liang, Jidong; Pan, Shaowu; Yang, Yu; Yang, Dengke; Cai, Yuepeng
One-pot synthesis of donor-acceptor [2]rotaxanes based on cryptand-paraquat recognition motif.
Organic & biomolecular chemistry, 2011, 9, 1237-1243
7151671 CIFC72 H92 F12 N2 O11 P2P 1 21/c 113.666; 17.343; 34.9
90; 106.726; 90
7922Xu, Zhikai; Jiang, Lasheng; Feng, Yahui; Zhang, Suhui; Liang, Jidong; Pan, Shaowu; Yang, Yu; Yang, Dengke; Cai, Yuepeng
One-pot synthesis of donor-acceptor [2]rotaxanes based on cryptand-paraquat recognition motif.
Organic & biomolecular chemistry, 2011, 9, 1237-1243
7151672 CIFC11 H11 Br2 N O5P -16.5189; 10.7194; 11.0482
65.732; 77.573; 80.693
684.99Shearman, James W.; Myers, Rebecca M.; Brenton, James D.; Ley, Steven V.
Total syntheses of subereamollines A and B.
Organic & biomolecular chemistry, 2011, 9, 62-65
7151673 CIFC11 H11 Br2 N O5P 1 21/c 110.9772; 25.2605; 10.1567
90; 104.6; 90
2725.4Shearman, James W.; Myers, Rebecca M.; Brenton, James D.; Ley, Steven V.
Total syntheses of subereamollines A and B.
Organic & biomolecular chemistry, 2011, 9, 62-65
7151674 CIFC10 H6 Br2 O4P n a 218.971; 10.6189; 22.6185
90; 90; 90
2154.69Shearman, James W.; Myers, Rebecca M.; Brenton, James D.; Ley, Steven V.
Total syntheses of subereamollines A and B.
Organic & biomolecular chemistry, 2011, 9, 62-65
7151675 CIFC13 H20 N2 O5C 1 2/c 120.618; 4.6216; 16.874
90; 117.449; 90
1426.9Zhang, Yagang; Song, Di; Brown, Julius C.; Shimizu, Ken D.
Suppression of background sites in molecularly imprinted polymers via urea-urea monomer aggregation.
Organic & biomolecular chemistry, 2011, 9, 120-126
7151676 CIFC20 H14 F3 N O3P 1 21/n 18.779; 15.427; 12.67
90; 94.858; 90
1709.78Wang, De-Wei; Syu, Siang-en; Hung, Yi-Ting; Chen, Pei-yi; Lee, Chia-Jui; Chen, Ko-Wei; Chen, Yu-Jhang; Lin, Wenwei
Organocatalytic tandem three-component reaction of aldehyde, alkyl vinyl ketone, and amide: one-pot syntheses of highly functional alkenes.
Organic & biomolecular chemistry, 2011, 9, 363-366
7151677 CIFC15 H15 Br N2 O3P -17.811; 8.3322; 12.4088
70.775; 89.288; 78.72
746.65Wang, De-Wei; Syu, Siang-en; Hung, Yi-Ting; Chen, Pei-yi; Lee, Chia-Jui; Chen, Ko-Wei; Chen, Yu-Jhang; Lin, Wenwei
Organocatalytic tandem three-component reaction of aldehyde, alkyl vinyl ketone, and amide: one-pot syntheses of highly functional alkenes.
Organic & biomolecular chemistry, 2011, 9, 363-366
7151678 CIFC21 H20 N2 O3P 1 21/n 19.8444; 10.7537; 17.1394
90; 100.088; 90
1786.39Wang, De-Wei; Syu, Siang-en; Hung, Yi-Ting; Chen, Pei-yi; Lee, Chia-Jui; Chen, Ko-Wei; Chen, Yu-Jhang; Lin, Wenwei
Organocatalytic tandem three-component reaction of aldehyde, alkyl vinyl ketone, and amide: one-pot syntheses of highly functional alkenes.
Organic & biomolecular chemistry, 2011, 9, 363-366
7151679 CIFC19 H16 N2 O6P c a b11.2975; 15.8036; 20.145
90; 90; 90
3596.71Wang, De-Wei; Syu, Siang-en; Hung, Yi-Ting; Chen, Pei-yi; Lee, Chia-Jui; Chen, Ko-Wei; Chen, Yu-Jhang; Lin, Wenwei
Organocatalytic tandem three-component reaction of aldehyde, alkyl vinyl ketone, and amide: one-pot syntheses of highly functional alkenes.
Organic & biomolecular chemistry, 2011, 9, 363-366
7151680 CIFC19 H16 Cl N O4P 1 21/c 17.8329; 16.6085; 13.2043
90; 101.014; 90
1686.14Wang, De-Wei; Syu, Siang-en; Hung, Yi-Ting; Chen, Pei-yi; Lee, Chia-Jui; Chen, Ko-Wei; Chen, Yu-Jhang; Lin, Wenwei
Organocatalytic tandem three-component reaction of aldehyde, alkyl vinyl ketone, and amide: one-pot syntheses of highly functional alkenes.
Organic & biomolecular chemistry, 2011, 9, 363-366
7151681 CIFC38 H36 N O7P -19.851; 11.303; 15.868
82.36; 76.88; 64.54
1552.4Liu, Jia; Wang, Xi; Sun, Chang-Liang; Li, Bi-Jie; Shi, Zhang-Jie; Wang, Min
New strategy to construct fused/bridged/spiro carbocyclic scaffolds based on the design of novel 6-C synthon precursor.
Organic & biomolecular chemistry, 2011, 9, 1572-1577
7151682 CIFC31 H34 O13P 1 21/n 112.624; 10.895; 21.852
90; 104.9; 90
2904.4Liu, Jia; Wang, Xi; Sun, Chang-Liang; Li, Bi-Jie; Shi, Zhang-Jie; Wang, Min
New strategy to construct fused/bridged/spiro carbocyclic scaffolds based on the design of novel 6-C synthon precursor.
Organic & biomolecular chemistry, 2011, 9, 1572-1577
7151683 CIFC20 H17 N3 O8P 21 21 219.7745; 9.7915; 20.5118
90; 90; 90
1963.12Sen, Subhabrata; Potti, Venkata R.; Surakanti, Ramu; Murthy, Y. L. N.; Pallepogu, Raghavaiah
Enantioselective synthesis of spirooxoindoles via chiral auxiliary (bicyclic lactam) controlled SNAr reactions.
Organic & biomolecular chemistry, 2011, 9, 358-360
7151684 CIFC16 H12 N2 O3P 21 21 217.471; 8.305; 21.194
90; 90; 90
1315.02Sunderland, Peter T.; Dhami, Archana; Mahon, Mary F.; Jones, Louise A.; Tully, Sophie R.; Lloyd, Matthew D.; Thompson, Andrew S.; Javaid, Hashim; Martin, Niall M. B.; Threadgill, Michael D.
Synthesis of 4-alkyl-, 4-aryl- and 4-arylamino-5-aminoisoquinolin-1-ones and identification of a new PARP-2 selective inhibitor.
Organic & biomolecular chemistry, 2011, 9, 881-891
7151685 CIFC16 H11 Br N2 O3P -18.618; 9.912; 10.226
114.347; 108.553; 100.738
701.65Sunderland, Peter T.; Dhami, Archana; Mahon, Mary F.; Jones, Louise A.; Tully, Sophie R.; Lloyd, Matthew D.; Thompson, Andrew S.; Javaid, Hashim; Martin, Niall M. B.; Threadgill, Michael D.
Synthesis of 4-alkyl-, 4-aryl- and 4-arylamino-5-aminoisoquinolin-1-ones and identification of a new PARP-2 selective inhibitor.
Organic & biomolecular chemistry, 2011, 9, 881-891
7151686 CIFC32 H24 N2 O4P 1 2/c 113.988; 10.997; 16.197
90; 95.645; 90
2479.44Sunderland, Peter T.; Dhami, Archana; Mahon, Mary F.; Jones, Louise A.; Tully, Sophie R.; Lloyd, Matthew D.; Thompson, Andrew S.; Javaid, Hashim; Martin, Niall M. B.; Threadgill, Michael D.
Synthesis of 4-alkyl-, 4-aryl- and 4-arylamino-5-aminoisoquinolin-1-ones and identification of a new PARP-2 selective inhibitor.
Organic & biomolecular chemistry, 2011, 9, 881-891
7151687 CIFC20 H16 Br N O5P 1 21 18.2259; 12.3386; 9.1136
90; 97.552; 90
917Jin, Zhichao; Yu, Feng; Wang, Xiao; Huang, Huicai; Luo, Xiaoyan; Liang, Xinmiao; Ye, Jinxing
A one-pot asymmetric organocatalytic tandem reaction for the synthesis of oxazine derivatives.
Organic & biomolecular chemistry, 2011, 9, 1809-1816
7151688 CIFC24 H25 F3 N2 O2 SP 21 21 219.6263; 14.1765; 16.473
90; 90; 90
2248Grellepois, Fabienne; Nonnenmacher, Jean; Lachaud, Fabien; Portella, Charles
Enantiomerically pure 2-aryl(alkyl)-2-trifluoromethylaziridines: synthesis and ring opening with selected O- and N-nucleophiles.
Organic & biomolecular chemistry, 2011, 9, 1160-1168
7151689 CIFC21 H20 F5 N O2 SP 43 21 29.7065; 9.7065; 45.227
90; 90; 90
4261.1Li, Peng; Liu, Li-Juan; Liu, Jin-Tao
Per(poly)fluoroalkanesulfinamides assisted diastereoselective three-component inverse-electron-demand aza Diels-Alder reaction.
Organic & biomolecular chemistry, 2011, 9, 74-77
7151690 CIFC14 H11 Cl F7 N O2 SP 1 21/c 112.1841; 5.7816; 24.406
90; 99.492; 90
1695.7Li, Peng; Liu, Li-Juan; Liu, Jin-Tao
Per(poly)fluoroalkanesulfinamides assisted diastereoselective three-component inverse-electron-demand aza Diels-Alder reaction.
Organic & biomolecular chemistry, 2011, 9, 74-77
7151691 CIFC25 H33 N O9P 21 21 2110.7328; 12.0282; 19.7768
90; 90; 90
2553.1Kurhade, Suresh E.; Mengawade, Tanaji; Bhuniya, Debnath; Palle, Venkata P.; Reddy, D. Srinivasa
Synthesis of novel sugar-lactam conjugates using the Aubé reaction.
Organic & biomolecular chemistry, 2011, 9, 744-747
7151692 CIFC14 H12 N2 O4 SP 1 21 16.771; 26.804; 7.448
90; 89.867; 90
1351.73Jeffs, Laura; Arquier, Damien; Kariuki, Benson; Bethell, Donald; Page, Philip C Bulman; Hutchings, Graham J.
On the enantioselectivity of aziridination of styrene catalysed by copper triflate and copper-exchanged zeolite Y: consequences of the phase behaviour of enantiomeric mixtures of N-arene-sulfonyl-2-phenylaziridines.
Organic & biomolecular chemistry, 2011, 9, 1079-1084
7151693 CIFC14 H12 N2 O4 SP 1 21/a 113.483; 7.543; 14.765
90; 114.997; 90
1360.98Jeffs, Laura; Arquier, Damien; Kariuki, Benson; Bethell, Donald; Page, Philip C Bulman; Hutchings, Graham J.
On the enantioselectivity of aziridination of styrene catalysed by copper triflate and copper-exchanged zeolite Y: consequences of the phase behaviour of enantiomeric mixtures of N-arene-sulfonyl-2-phenylaziridines.
Organic & biomolecular chemistry, 2011, 9, 1079-1084
7151694 CIFC21 H31 N3 O7P 1 21/c 110.158; 14.069; 17.637
90; 99.962; 90
2482.6Desmarchelier, Alaric; Marrot, Jérôme; Moreau, Xavier; Greck, Christine
Asymmetric organocatalytic Michael-α-amination sequence for the construction of a quaternary stereocenter.
Organic & biomolecular chemistry, 2011, 9, 994-997
7151695 CIFC20 H16 N2 OC 1 2/c 123.0916; 7.3204; 38.0041
90; 97.32; 90
6371.8Wu, Hung-Chou; Hwang, Long-Chih; Wu, Ming-Jung
A copper-mediated cyclization reaction of hydrazine with enediynones providing pyrazolo[1,5-a]pyridines.
Organic & biomolecular chemistry, 2011, 9, 670-672
7151696 CIFC38 H42 Cu2 N4P 1 21/a 114.2593; 12.1166; 19.4748
90; 101.738; 90
3294.38Wu, Hung-Chou; Hwang, Long-Chih; Wu, Ming-Jung
A copper-mediated cyclization reaction of hydrazine with enediynones providing pyrazolo[1,5-a]pyridines.
Organic & biomolecular chemistry, 2011, 9, 670-672
7151697 CIFC17 H19 Cl Cu N2 OP -19.3101; 9.2508; 11.242
69.333; 84.453; 76.764
881.72Wu, Hung-Chou; Hwang, Long-Chih; Wu, Ming-Jung
A copper-mediated cyclization reaction of hydrazine with enediynones providing pyrazolo[1,5-a]pyridines.
Organic & biomolecular chemistry, 2011, 9, 670-672
7151698 CIFC22 H22 O4P -16.0102; 10.0194; 15.9053
81.28; 83.245; 75.899
914.94Sada, Mutsumi; Nomura, Kenichi; Matsubara, Seijiro
A tandem reaction of organozinc reagent prepared from palladium-catalyzed umpolung method: diastereoselective formation of cyclohexene derivatives bearing three adjacent stereocenters.
Organic & biomolecular chemistry, 2011, 9, 1389-1393
7151699 CIFC13 H13 N O2P c a 218.894; 8.467; 15.2509
90; 90; 90
1148.48Smith, Catherine J.; Smith, Christopher D.; Nikbin, Nikzad; Ley, Steven V.; Baxendale, Ian R.
Flow synthesis of organic azides and the multistep synthesis of imines and amines using a new monolithic triphenylphosphine reagent.
Organic & biomolecular chemistry, 2011, 9, 1927-1937
7151700 CIFC7 H3 Br N4P -17.4355; 8.5948; 13.7214
88.715; 89.784; 68.818
817.43Smith, Catherine J.; Smith, Christopher D.; Nikbin, Nikzad; Ley, Steven V.; Baxendale, Ian R.
Flow synthesis of organic azides and the multistep synthesis of imines and amines using a new monolithic triphenylphosphine reagent.
Organic & biomolecular chemistry, 2011, 9, 1927-1937
7151701 CIFC10 H9 N5 OC 1 2/c 127.8326; 6.2301; 11.8916
90; 94.99; 90
2054.19Smith, 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
7151702 CIFC11 H7 N5C 1 c 110.1129; 14.736; 7.3628
90; 118.152; 90
967.43Smith, 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
7151703 CIFC12 H13 N5C 1 2/c 133.4277; 6.1102; 12.4082
90; 106.375; 90
2431.57Smith, 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
7151704 CIFC10 H5 Br N6P -17.2576; 8.4262; 8.8405
97.305; 110.101; 90.585
502.74Smith, 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
7151705 CIFC18 H28 N2 O6 Se2P 1 21 16.9783; 11.2514; 14.4801
90; 91.389; 90
1136.58Bhuyan, Bhaskar J.; Mugesh, Govindasamy
Synthesis, characterization and antioxidant activity of angiotensin converting enzyme inhibitors.
Organic & biomolecular chemistry, 2011, 9, 1356-1365
7151706 CIFC21 H36 Br N2 O3P 15.3658; 10.1748; 10.905
82.918; 88.385; 78.119
578.17Bhuyan, Bhaskar J.; Mugesh, Govindasamy
Synthesis, characterization and antioxidant activity of angiotensin converting enzyme inhibitors.
Organic & biomolecular chemistry, 2011, 9, 1356-1365
7151707 CIFC10 H12 O3 SeP 21 a b5.7334; 7.899; 47.642
90; 90; 90
2157.6Bhuyan, Bhaskar J.; Mugesh, Govindasamy
Synthesis, characterization and antioxidant activity of angiotensin converting enzyme inhibitors.
Organic & biomolecular chemistry, 2011, 9, 1356-1365

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