Crystallography Open Database

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7150796 CIFC25 H28 N2 O6P -15.07959; 16.8946; 27.9131
78.308; 89.999; 81.384
2318.12Ando, Kumiko; Kawamura, Yoko; Akai, Yukiko; Kunitomo, Jun-ichi; Yokomizo, Takehiko; Yamashita, Masayuki; Ohta, Shunsaku; Ohishi, Takahiro; Ohishi, Yoshitaka
Preparation of 2-, 3-, 4- and 7-(2-alkylcarbamoyl-1-alkylvinyl)benzo[b]furans and their BLT1 and/or BLT2 inhibitory activities
Organic & Biomolecular Chemistry, 2008, 6, 296-307
7150797 CIFC25 H28 N2 O6C 1 2/c 133.4101; 5.07911; 27.9188
90; 101.832; 90
4637Ando, Kumiko; Kawamura, Yoko; Akai, Yukiko; Kunitomo, Jun-ichi; Yokomizo, Takehiko; Yamashita, Masayuki; Ohta, Shunsaku; Ohishi, Takahiro; Ohishi, Yoshitaka
Preparation of 2-, 3-, 4- and 7-(2-alkylcarbamoyl-1-alkylvinyl)benzo[b]furans and their BLT1 and/or BLT2 inhibitory activities
Organic & Biomolecular Chemistry, 2008, 6, 296-307
7150798 CIFC24 H37 N O2P -110.2817; 10.6027; 11.7395
64.164; 86.195; 73.578
1102.46Krawczyk, Henryk; Wąsek, Katarzyna; Kędzia, Jacek; Wojciechowski, Jakub; Wolf, Wojciech M.
A general stereoselective method for the synthesis of cyclopropanecarboxylates. A new version of the homologous Horner‒Wadsworth‒Emmons reaction
Organic & Biomolecular Chemistry, 2008, 6, 308-318
7150799 CIFC35 H35 N3 O9P -18.068; 10.874; 19.198
105.27; 98.082; 98.075
1580.65Plante, Jeffrey; Campbell, Fred; Malkova, Barbora; Kilner, Colin; Warriner, Stuart L.; Wilson, Andrew J.
Synthesis of functionalised aromatic oligamide rods
Organic & Biomolecular Chemistry, 2008, 6, 138-146
7150800 CIFC23 H25 N3 O3C 1 c 111.961; 19.647; 9.048
90; 94.251; 90
2120.4Korotkikh, Nikolai I.; Cowley, Alan H.; Moore, Jennifer A.; Glinyanaya, Nataliya V.; Panov, Ilia S.; Rayenko, Gennady F.; Pekhtereva, Tatyana M.; Shvaika, Oles P.
Reaction of 1-tert-butyl-3,4-diphenyl-1,2,4-triazol-5-ylidenes with a malonic ester
Organic & Biomolecular Chemistry, 2008, 6, 195-199
7150801 CIFC54 H56 O6P 1 21/c 117.3668; 11.4423; 23.2936
90; 108.973; 90
4377.3Barton, Olaf G.; Neumann, B.; Stammler, H.-G.; Mattay, Jochen
Intramolecular direct arylation in an A,C-functionalized calix[4]arene
Organic & Biomolecular Chemistry, 2008, 6, 104-111
7150802 CIFC54 H56 O6P -111.5936; 11.6506; 17.2247
73.0552; 75.3562; 77.6072
2128.17Barton, Olaf G.; Neumann, B.; Stammler, H.-G.; Mattay, Jochen
Intramolecular direct arylation in an A,C-functionalized calix[4]arene
Organic & Biomolecular Chemistry, 2008, 6, 104-111
7150803 CIFC23 H22 Co2 N2 O12P 21 21 218.7674; 9.3303; 31.529
90; 90; 90
2579.2Sergeant, Craig D.; Ott, Ingo; Sniady, Adam; Meneni, Srinivasarao; Gust, Ronald; Rheingold, Arnold L.; Dembinski, Roman
Metallo-nucleosides: synthesis and biological evaluation of hexacarbonyl dicobalt 5-alkynyl-2′-deoxyuridines
Organic & Biomolecular Chemistry, 2008, 6, 73-80
7150804 CIFC15 H15 N3P 1 21/c 19.5122; 13.5695; 9.9716
90; 106.4; 90
1234.73Johnston, Karen A.; Allcock, Robert W.; Jiang, Zhong; Collier, Ian D.; Blakli, Haakon; Rosair, Georgina M.; Bailey, Patrick D.; Morgan, Keith M.; Kohno, Yasushi; Adams, David R.
Concise routes to pyrazolo[1,5-a]pyridin-3-yl pyridazin-3-ones
Organic & Biomolecular Chemistry, 2008, 6, 175-186
7150805 CIFC21 H22 N4 OP 1 21/n 18.176; 23.3585; 9.0849
90; 95.397; 90
1727.33Johnston, Karen A.; Allcock, Robert W.; Jiang, Zhong; Collier, Ian D.; Blakli, Haakon; Rosair, Georgina M.; Bailey, Patrick D.; Morgan, Keith M.; Kohno, Yasushi; Adams, David R.
Concise routes to pyrazolo[1,5-a]pyridin-3-yl pyridazin-3-ones
Organic & Biomolecular Chemistry, 2008, 6, 175-186
7150806 CIFC21 H20 N4 OP 1 21/n 18.9123; 10.1067; 19.3558
90; 90.98; 90
1743.2Johnston, Karen A.; Allcock, Robert W.; Jiang, Zhong; Collier, Ian D.; Blakli, Haakon; Rosair, Georgina M.; Bailey, Patrick D.; Morgan, Keith M.; Kohno, Yasushi; Adams, David R.
Concise routes to pyrazolo[1,5-a]pyridin-3-yl pyridazin-3-ones
Organic & Biomolecular Chemistry, 2008, 6, 175-186
7150807 CIFC16 H28 N4 O9 SP 1 21 15.2709; 16.736; 12.148
90; 97.432; 90
1062.6Christensen, Mikkel S.; Bond, Andrew D.; Nielsen, Poul
Synthetic nucleic acid secondary structures containing the four stereoisomers of 1,4-bis(thymine-1-yl)butane-2,3-diol
Organic & Biomolecular Chemistry, 2008, 6, 81-91
7150808 CIFC18 H30 N4 O8 S2P -15.224; 9.313; 12.558
101.76; 91.68; 105
575.6Christensen, Mikkel S.; Bond, Andrew D.; Nielsen, Poul
Synthetic nucleic acid secondary structures containing the four stereoisomers of 1,4-bis(thymine-1-yl)butane-2,3-diol
Organic & Biomolecular Chemistry, 2008, 6, 81-91
7150809 CIFC35 H25 N OP -112.1762; 17.4387; 20.106
80.239; 73.766; 73.137
3904.56D'Souza, Daniel M.; Liao, Wei-Wei; Rominger, Frank; Müller, Thomas J. J.
Dichotomies in microwave-assisted propargyl-isomerization‒Claisen domino sequences dependent on base strengths
Organic & Biomolecular Chemistry, 2008, 6, 532-539
7150810 CIFC29 H24 OP -18.519; 12.585; 10.241
73.057; 86.768; 98.877
1031.73D'Souza, Daniel M.; Liao, Wei-Wei; Rominger, Frank; Müller, Thomas J. J.
Dichotomies in microwave-assisted propargyl-isomerization‒Claisen domino sequences dependent on base strengths
Organic & Biomolecular Chemistry, 2008, 6, 532-539
7150811 CIFC37 H31 N O4P 1 21/c 115.348; 8.806; 22.612
90; 109.831; 90
2874.9D'Souza, Daniel M.; Liao, Wei-Wei; Rominger, Frank; Müller, Thomas J. J.
Dichotomies in microwave-assisted propargyl-isomerization‒Claisen domino sequences dependent on base strengths
Organic & Biomolecular Chemistry, 2008, 6, 532-539
7150812 CIFC29 H24 O2P c c n15.277; 37.64; 7.251
90; 90; 90
4169.5D'Souza, Daniel M.; Liao, Wei-Wei; Rominger, Frank; Müller, Thomas J. J.
Dichotomies in microwave-assisted propargyl-isomerization‒Claisen domino sequences dependent on base strengths
Organic & Biomolecular Chemistry, 2008, 6, 532-539
7150813 CIFC14 H17 Cl2 N OP 1 21 19.82; 9.82; 16.09
90; 101.08; 90
1523Yasukochi, Hiroaki; Atago, Takayuki; Tanaka, Akihiro; Nakatsuji, Hidefumi; Yoshida, Eri; Kakehi, Akikazu; Nishii, Yoshinori; Tanabe, Yoo
Practical, general, and systematic method for optical resolution of gem-dihalo- and monohalocyclopropanecarboxylic acids utilizing chiral 1,1′-binaphtholmonomethyl ethers: Application to the synthesis of three chiral pesticides
Organic & Biomolecular Chemistry, 2008, 6, 540-547
7150814 CIFC28 H30 N2 O3 S2P 21 21 214.5931; 21.5413; 8.0149
90; 90; 90
2519.52Cheruku, Pradeep; Paptchikhine, Alexander; Ali, Muhammad; Neudörfl, Jörg-M.; Andersson, Pher G.
Development of new thiazole-based iridium catalysts and their applications in the asymmetric hydrogenation of trisubstituted olefins
Organic & Biomolecular Chemistry, 2008, 6, 366-373
7150815 CIFC28 H46 O5 SiP 21 21 218.43; 16.304; 20.801
90; 90; 90
2858.9Burton, Jonathan W.; Anderson, Edward A.; O'Sullivan, Paul T.; Collins, Ian; Davies, John E.; Bond, Andrew D.; Feeder, Neil; Holmes, Andrew B.
The Claisen rearrangement approach to fused bicyclic medium-ring oxacycles
Organic & Biomolecular Chemistry, 2008, 6, 693-702
7150816 CIFC19 H26 O4P 1 21 110.819; 5.371; 15.64
90; 102.809; 90
886.21Burton, Jonathan W.; Anderson, Edward A.; O'Sullivan, Paul T.; Collins, Ian; Davies, John E.; Bond, Andrew D.; Feeder, Neil; Holmes, Andrew B.
The Claisen rearrangement approach to fused bicyclic medium-ring oxacycles
Organic & Biomolecular Chemistry, 2008, 6, 693-702
7150817 CIFC12 H14 O5P 21 21 217.8054; 10.1991; 14.3886
90; 90; 90
1145.45Burton, Jonathan W.; Anderson, Edward A.; O'Sullivan, Paul T.; Collins, Ian; Davies, John E.; Bond, Andrew D.; Feeder, Neil; Holmes, Andrew B.
The Claisen rearrangement approach to fused bicyclic medium-ring oxacycles
Organic & Biomolecular Chemistry, 2008, 6, 693-702
7150818 CIFC26 H44 O5 SiP 21 21 218.04; 16.929; 19.604
90; 90; 90
2668.3Burton, Jonathan W.; Anderson, Edward A.; O'Sullivan, Paul T.; Collins, Ian; Davies, John E.; Bond, Andrew D.; Feeder, Neil; Holmes, Andrew B.
The Claisen rearrangement approach to fused bicyclic medium-ring oxacycles
Organic & Biomolecular Chemistry, 2008, 6, 693-702
7150819 CIFC13 H16 O4P 1 21 17.72; 6.415; 12.126
90; 96.616; 90
596.5Burton, Jonathan W.; Anderson, Edward A.; O'Sullivan, Paul T.; Collins, Ian; Davies, John E.; Bond, Andrew D.; Feeder, Neil; Holmes, Andrew B.
The Claisen rearrangement approach to fused bicyclic medium-ring oxacycles
Organic & Biomolecular Chemistry, 2008, 6, 693-702
7150820 CIFC11 H16 O4P 6314.3428; 14.3428; 8.9246
90; 90; 120
1589.96Burton, Jonathan W.; Anderson, Edward A.; O'Sullivan, Paul T.; Collins, Ian; Davies, John E.; Bond, Andrew D.; Feeder, Neil; Holmes, Andrew B.
The Claisen rearrangement approach to fused bicyclic medium-ring oxacycles
Organic & Biomolecular Chemistry, 2008, 6, 693-702
7150821 CIFC22 H30 Mg O10P -18.279; 8.724; 9.245
97.164; 94.153; 116.289
587.8Bernat, Virginie; André, Chantal; André-Barrès, Christiane
Weak chemiluminescence emission during base induced rearrangement of G-factors
Organic & Biomolecular Chemistry, 2008, 6, 454-457
7150822 CIFC24 H28P -111.4202; 13.2038; 13.6607
106.538; 90.402; 115.04
1769.71Pollard, Michael M.; Meetsma, Auke; Feringa, Ben L.
A redesign of light-driven rotary molecular motors
Organic & Biomolecular Chemistry, 2008, 6, 507-512
7150823 CIFC24 H28C 1 2/c 138.531; 5.981; 16.016
90; 93.416; 90
3684.4Pollard, Michael M.; Meetsma, Auke; Feringa, Ben L.
A redesign of light-driven rotary molecular motors
Organic & Biomolecular Chemistry, 2008, 6, 507-512
7150824 CIFC22 H28 N2 O5 SP 1 21 17.9098; 16.815; 8.1247
90; 91.953; 90
1079.98Prieto, Oscar; Lam, Hon Wai
Cobalt-catalyzed reductive Mannich reactions of 4-acryloylmorpholine with N-tosyl aldimines
Organic & Biomolecular Chemistry, 2008, 6, 55-57
7150825 CIFC18 H22 N2 O4 S2P -15.9601; 9.7146; 16.6249
100.634; 100.386; 99.836
909.57Prieto, Oscar; Lam, Hon Wai
Cobalt-catalyzed reductive Mannich reactions of 4-acryloylmorpholine with N-tosyl aldimines
Organic & Biomolecular Chemistry, 2008, 6, 55-57
7150826 CIFC22 H28 N2 O5 SP c c n22.1667; 25.5085; 7.5733
90; 90; 90
4282.2Prieto, Oscar; Lam, Hon Wai
Cobalt-catalyzed reductive Mannich reactions of 4-acryloylmorpholine with N-tosyl aldimines
Organic & Biomolecular Chemistry, 2008, 6, 55-57
7150827 CIFC28 H40 F6 N2 O10P 1 21 111.949; 9.313; 15.289
90; 101.84; 90
1665.2Oelze, Benjamin; Albert, Dieter; Kirschning, Andreas
Synthetic and structural studies on macrocyclic amino cyclitols ‒ conformational chameleons
Organic & Biomolecular Chemistry, 2008, 6, 2412-2425
7150828 CIFC20 H30 N4 O13 OsP 1 21 111.4747; 6.7238; 15.8519
90; 97.2644; 90
1213.2Umemoto, Tadashi; Okamoto, Akimitsu
Synthesis and characterization of the 5-methyl-2′-deoxycytidine glycol‒dioxoosmium‒bipyridine ternary complex in DNA
Organic & Biomolecular Chemistry, 2008, 6, 269-271
7150829 CIFC15 H13 Br O4P -16.7091; 8.077; 13.7233
103.96; 93.8881; 109.004
673.62Pearson, Emma L.; Willis, Anthony C.; Sherburn, Michael S.; Paddon-Row, Michael N.
Controlling cis/trans-selectivity in intramolecular Diels‒Alder reactions of benzo-tethered, ester linked 1,3,9-decatrienes
Organic & Biomolecular Chemistry, 2008, 6, 513-522
7150830 CIFC18 H22 O4 SiC 1 2/c 144.1595; 6.5892; 30.3735
90; 127.205; 90
7039.2Pearson, Emma L.; Willis, Anthony C.; Sherburn, Michael S.; Paddon-Row, Michael N.
Controlling cis/trans-selectivity in intramolecular Diels‒Alder reactions of benzo-tethered, ester linked 1,3,9-decatrienes
Organic & Biomolecular Chemistry, 2008, 6, 513-522
7150831 CIFC15 H13 Br O4P 1 21/c 19.308; 10.106; 14.4185
90; 95.7272; 90
1349.53Pearson, Emma L.; Willis, Anthony C.; Sherburn, Michael S.; Paddon-Row, Michael N.
Controlling cis/trans-selectivity in intramolecular Diels‒Alder reactions of benzo-tethered, ester linked 1,3,9-decatrienes
Organic & Biomolecular Chemistry, 2008, 6, 513-522
7150832 CIFC18 H22 O4 SiP -19.3794; 9.9026; 10.4159
86.4869; 66.0202; 79.5571
869.21Pearson, Emma L.; Willis, Anthony C.; Sherburn, Michael S.; Paddon-Row, Michael N.
Controlling cis/trans-selectivity in intramolecular Diels‒Alder reactions of benzo-tethered, ester linked 1,3,9-decatrienes
Organic & Biomolecular Chemistry, 2008, 6, 513-522
7150833 CIFC16 H12 O6P n a 2111.7777; 5.4798; 20.1905
90; 90; 90
1303.08Pearson, Emma L.; Willis, Anthony C.; Sherburn, Michael S.; Paddon-Row, Michael N.
Controlling cis/trans-selectivity in intramolecular Diels‒Alder reactions of benzo-tethered, ester linked 1,3,9-decatrienes
Organic & Biomolecular Chemistry, 2008, 6, 513-522
7150834 CIFC17 H27 Cu F6 N3 O4P 21 21 218.3666; 15.4945; 16.3029
90; 90; 90
2113.45Stones, Graham; Tripoli, Régis; McDavid, Colin L.; Roux-Duplâtre, Kewin; Kennedy, Alan R.; Sherrington, David C.; Gibson, Colin L.
Investigation of macrocyclisation routes to 1,4,7-triazacyclononanes: efficient syntheses from 1,2-ditosylamides
Organic & Biomolecular Chemistry, 2008, 6, 374-384
7150835 CIFC12 H18 O3 SP 1 21/n 18.5196; 11.9778; 11.9934
90; 90.014; 90
1223.88Flemming, Jonathan P.; Berry, Malcolm B.; Brown, John M.
Sequential ortho-lithiations; the sulfoxide group as a relay to enable meta-substitution
Organic & Biomolecular Chemistry, 2008, 6, 1215-1221
7150836 CIFC12 H16 O3 SP 1 21/n 18.8092; 11.8522; 11.5256
90; 91.543; 90
1202.93Flemming, Jonathan P.; Berry, Malcolm B.; Brown, John M.
Sequential ortho-lithiations; the sulfoxide group as a relay to enable meta-substitution
Organic & Biomolecular Chemistry, 2008, 6, 1215-1221
7150837 CIFC12 H18 O2 SP 1 21/n 18.445; 12.0343; 11.7417
90; 91.0936; 90
1193.09Flemming, Jonathan P.; Berry, Malcolm B.; Brown, John M.
Sequential ortho-lithiations; the sulfoxide group as a relay to enable meta-substitution
Organic & Biomolecular Chemistry, 2008, 6, 1215-1221
7150838 CIFC14 H15.3 N5 O6.15P 21 21 215.9329; 14.5318; 18.898
90; 90; 90
1629.3Anegundi, Ramakrishna I.; Puranik, Vedavati G.; Hotha, Srinivas
Synthesis of 1,2,3-triazole and 1,2,3,4-tetrazole-fused glycosides and nucleosides by an intramolecular 1,3-dipolar cycloaddition reaction
Organic & Biomolecular Chemistry, 2008, 6, 779-786
7150839 CIFC10 H14 N4 O4P 21 21 215.6672; 9.8214; 21.2188
90; 90; 90
1181.03Anegundi, Ramakrishna I.; Puranik, Vedavati G.; Hotha, Srinivas
Synthesis of 1,2,3-triazole and 1,2,3,4-tetrazole-fused glycosides and nucleosides by an intramolecular 1,3-dipolar cycloaddition reaction
Organic & Biomolecular Chemistry, 2008, 6, 779-786
7150840 CIFC11 H15 N3 O4P 21 21 215.495; 10.054; 21.33
90; 90; 90
1178.4Anegundi, Ramakrishna I.; Puranik, Vedavati G.; Hotha, Srinivas
Synthesis of 1,2,3-triazole and 1,2,3,4-tetrazole-fused glycosides and nucleosides by an intramolecular 1,3-dipolar cycloaddition reaction
Organic & Biomolecular Chemistry, 2008, 6, 779-786
7150841 CIFC30 H45 N O4P 1 21 112.595; 6.1165; 18.862
90; 106.42; 90
1393.8Taniguchi, Kayoko; Aruga, Marie; Yasutake, Mikio; Hirose, Takuji
Solvent control of optical resolution of 2-amino-1-phenylethanol using dehydroabietic acid
Organic & Biomolecular Chemistry, 2008, 6, 458-463
7150842 CIFC28 H39 N O3P 1 21 110.981; 6.1913; 17.85
90; 90.37; 90
1213.5Taniguchi, Kayoko; Aruga, Marie; Yasutake, Mikio; Hirose, Takuji
Solvent control of optical resolution of 2-amino-1-phenylethanol using dehydroabietic acid
Organic & Biomolecular Chemistry, 2008, 6, 458-463
7150843 CIFC48 H67 N O5P 21 21 216.3023; 19.07; 35.095
90; 90; 90
4217.9Taniguchi, Kayoko; Aruga, Marie; Yasutake, Mikio; Hirose, Takuji
Solvent control of optical resolution of 2-amino-1-phenylethanol using dehydroabietic acid
Organic & Biomolecular Chemistry, 2008, 6, 458-463
7150844 CIFC13 H13 N4 O7 PP -18.2246; 8.6176; 11.5999
69.521; 88.202; 85.002
767.27Griffiths, D. Vaughan; Al-Jeboori, Mohamad J.; Cheong, Yuen-Ki; Duncanson, Philip; Harris, Jayne E.; Salt, Michael C.; Taylor, Helen V.
Electron-rich heteroaroylphosphonates and their reaction with trimethyl phosphite
Organic & Biomolecular Chemistry, 2008, 6, 577-585
7150845 CIFC15 H13 N3 O SP 1 21/n 14.9892; 19.2928; 14.7103
90; 99.045; 90
1398.34Basheer, Ahmad; Rappoport, Zvi
Enols and thioenols of substituted cyanomonothiocarbonylmalonamides: structures, enolization vs. thioenolization, equilibria and conformations
Organic & Biomolecular Chemistry, 2008, 6, 1071-1082

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