# Search results of SQL query from the Crystallography Open Database # Date and time performed: 2024-12-12T02:33:07+01:00 # Query: # SELECT data.* # FROM # data JOIN jaltnames # ON altname = journal # WHERE # (status is null or status != 'retracted') and # (journal_id IN (SELECT DISTINCT(journal_id) FROM jaltnames WHERE altname LIKE 'Journal of natural products') AND volume = 71 AND duplicateof IS NULL AND (status is NULL OR status != 'errors') AND (method is NULL OR method != 'theoretical')) # ORDER BY file asc file,a,siga,b,sigb,c,sigc,alpha,sigalpha,beta,sigbeta,gamma,siggamma,vol,sigvol,celltemp,sigcelltemp,diffrtemp,sigdiffrtemp,cellpressure,sigcellpressure,diffrpressure,sigdiffrpressure,thermalhist,pressurehist,compoundsource,nel,sg,sgHall,sgNumber,commonname,chemname,mineral,formula,calcformula,cellformula,Z,Zprime,acce_code,authors,title,journal,year,volume,issue,firstpage,lastpage,doi,method,radiation,wavelength,radType,radSymbol,Rall,Robs,Rref,wRall,wRobs,wRref,RFsqd,RI,gofall,gofobs,gofgt,gofref,duplicateof,optimal,status,flags,svnrevision,date,time,onhold "1504443","7.5554","0.0011","9.0441","0.0013","22.351","0.003","90","","90","","90","","1527.3","0.4","173","2","173","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C19 H20 O6 -","- C19 H20 O6 -","- C76 H80 O24 -","4","1","","Fotso, Serge; Mahmud, Taifo; Zabriskie, T. Mark; Santosa, Dwi Andreas; Sulastri,; Proteau, Philip J.","Angucyclinones from an Indonesian Streptomyces sp.","Journal of natural products","2008","71","1","61","65","10.1021/np0704102","","","0.71073","MoKα","","0.0304","0.03","","","0.0816","0.0821","","","","","","1.038","","","","has coordinates","201954","2020-10-21","18:00:00","" "1504444","32.341","0.014","8.429","0.003","12.051","0.005","90","","95.82","0.03","90","","3268","2","294","2","294","2","","","","","","","","3","C 1 2 1","C 2y","5","","","","- C33.5 H54 O7 -","- C33.5 H54 O7 -","- C134 H216 O28 -","4","1","","Chen, Jian-Jun; Fei, Dong-Qing; Chen, Sheng-Gao; Gao, Kun","Antimicrobial triterpenoids from Vladimiria muliensis.","Journal of natural products","2008","71","4","547","550","10.1021/np070483l","","","0.71073","MoKα","","0.0947","0.06","","","0.1496","0.1727","","","","","","1.047","","","","has coordinates","176435","2020-10-21","18:00:00","" "1504445","7.544","0.001","6.066","0.001","20.579","0.001","90","","99.92","0.04","90","","927.7","0.2","295","2","295","2","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C20 H30 O5 -","- C20 H30 O5 -","- C40 H60 O10 -","2","1","","Yan, Ren-Yi; Tan, Yong-Xia; Cui, Xi-Qiang; Chen, Ruo-Yun; Yu, De-Quan","Diterpenoids from the roots of Suregada glomerulata.","Journal of natural products","2008","71","2","195","198","10.1021/np0705211","","","0.71073","MoKα","","0.089","0.0888","","","0.2068","0.207","","","","","","1.062","","","","has coordinates","201954","2020-10-21","18:00:00","" "1504446","12.1841","0.0002","14.0401","0.0002","20.8894","0.0004","90","","90","","90","","3573.47","0.1","295","2","295","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C20 H30 O4 -","- C20 H30 O4 -","- C160 H240 O32 -","8","2","","Chou, Bo-Hon; Yang, Li-Ming; Chang, Shwu-Fen; Hsu, Feng-Lin; Lo, Chia-Hsin; Liaw, Jia-Horng; Liu, Pan-Chun; Lin, Shwu-Jiuan","Microbial transformation of isosteviol lactone and evaluation of the transformation products on androgen response element.","Journal of natural products","2008","71","4","602","607","10.1021/np070585b","","","0.71073","MoKα","","0.0567","0.0447","","","0.1228","0.1343","","","","","","1.037","","","","has coordinates","201954","2020-10-21","18:00:00","" "1504447","7.127","0.0008","13.9423","0.0016","14.4961","0.0016","90","","90","","90","","1440.4","0.3","298","2","298","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C12 H20 O7 -","- C12 H20 O7 -","- C48 H80 O28 -","4","1","","Wu, Shao-Hua; Chen, You-Wei; Shao, Shi-Cheng; Wang, Li-Dong; Li, Zhi-Ying; Yang, Li-Yuan; Li, Shao-Lan; Huang, Rong","Ten-membered lactones from Phomopsis sp., an endophytic fungus of Azadirachta indica.","Journal of natural products","2008","71","4","731","734","10.1021/np070624j","","","0.71073","MoKα","","0.0889","0.0498","","","0.0905","0.1061","","","","","","1.024","","","","has coordinates","201954","2020-10-21","18:00:00","" "1504448","7.5444","0.0007","9.8302","0.0009","16.6997","0.0015","90","","90","","90","","1238.5","0.2","571","2","298","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C12 H16 O6 -","- C12 H16 O6 -","- C48 H64 O24 -","4","1","","Wu, Shao-Hua; Chen, You-Wei; Shao, Shi-Cheng; Wang, Li-Dong; Li, Zhi-Ying; Yang, Li-Yuan; Li, Shao-Lan; Huang, Rong","Ten-membered lactones from Phomopsis sp., an endophytic fungus of Azadirachta indica.","Journal of natural products","2008","71","4","731","734","10.1021/np070624j","","","0.71073","MoKα","","0.044","0.0365","","","0.0832","0.0879","","","","","","1.024","","","","has coordinates","201954","2020-10-21","18:00:00","" "1504449","7.8919","0.0004","12.0853","0.0009","43.592","0.003","90","","90","","90","","4157.6","0.5","298","","","","","","","","","","Phyllanthus acutissima","4","P 21 21 21","P 2ac 2ab","19","","","","- C47 H53 Br O9 -","- C47 H53 Br O9 -","- C188 H212 Br4 O36 -","4","1","","Tuchinda, Patoomratana; Kornsakulkarn, Jittra; Pohmakotr, Manat; Kongsaeree, Palangpon; Prabpai, Samran; Yoosook, Chalobon; Kasisit, Jitra; Napaswad, Chanita; Sophasan, Samaisukh; Reutrakul, Vichai","Dichapetalin-type triterpenoids and lignans from the aerial parts of Phyllanthus acutissima.","Journal of natural products","2008","71","4","655","663","10.1021/np7007347","","","0.71073","MoKα","","0.0585","0.0476","","","0.1106","0.1183","","","","","","1.05","","","","has coordinates","176435","2020-10-21","18:00:00","" "1504450","10.1863","0.0005","14.2352","0.001","14.5801","0.0008","90","","97.652","0.004","90","","2095.3","0.2","298","","","","","","","","","","Phyllanthus acutissima","4","P 1 21 1","P 2yb","4","","","","- C47 H55 Br O10 -","- C47 H55 Br O10 -","- C94 H110 Br2 O20 -","2","1","","Tuchinda, Patoomratana; Kornsakulkarn, Jittra; Pohmakotr, Manat; Kongsaeree, Palangpon; Prabpai, Samran; Yoosook, Chalobon; Kasisit, Jitra; Napaswad, Chanita; Sophasan, Samaisukh; Reutrakul, Vichai","Dichapetalin-type triterpenoids and lignans from the aerial parts of Phyllanthus acutissima.","Journal of natural products","2008","71","4","655","663","10.1021/np7007347","","","0.71073","MoKα","","0.0611","0.0459","","","0.1136","0.1289","","","","","","1.029","","","","has coordinates","176435","2020-10-21","18:00:00","" "1504451","6.465","0.002","10.184","0.004","25.525","0.009","90","","90","","90","","1680.6","1","294","2","294","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C16 H24 O6 -","- C16 H24 O6 -","- C64 H96 O24 -","4","1","","Li, Erwei; Tian, Renrong; Liu, Shuchun; Chen, Xulin; Guo, Liangdong; Che, Yongsheng","Pestalotheols A-D, bioactive metabolites from the plant endophytic fungus Pestalotiopsis theae.","Journal of natural products","2008","71","4","664","668","10.1021/np700744t","","","0.71073","MoKα","","0.1042","0.0524","","","0.1156","0.1339","","","","","","1.027","","","","has coordinates","201954","2020-10-21","18:00:00","" "1504452","6.415","0.003","19.316","0.007","26.196","0.008","90","","90","","90","","3246","2","298","2","298","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C37 H45 N O5 -","- C37 H45 N O5 -","- C148 H180 N4 O20 -","4","1","","Yang, Cheng-Hui; Cheng, Ming-Jen; Chiang, Michael Y.; Kuo, Yueh-Hsiung; Wang, Chyi-Jia; Chen, Ih-Sheng","Dihydrobenzo[c]phenanthridine alkaloids from stem bark of Zanthoxylum nitidum.","Journal of natural products","2008","71","4","669","673","10.1021/np700745f","","","0.71073","MoKα","","0.0832","0.0426","","","0.1003","0.116","","","","","","1.04","","","","has coordinates","201954","2020-10-21","18:00:00","" "1504453","6.9588","0.0017","12.409","0.003","18.863","0.004","90","","90","0.02","90","","1628.9","0.7","298","2","298","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C37 H45 N O5 -","- C37 H45 N O5 -","- C74 H90 N2 O10 -","2","1","","Yang, Cheng-Hui; Cheng, Ming-Jen; Chiang, Michael Y.; Kuo, Yueh-Hsiung; Wang, Chyi-Jia; Chen, Ih-Sheng","Dihydrobenzo[c]phenanthridine alkaloids from stem bark of Zanthoxylum nitidum.","Journal of natural products","2008","71","4","669","673","10.1021/np700745f","","","0.71073","MoKα","","0.2198","0.0466","","","0.1113","0.1645","","","","","","0.927","","","","has coordinates","201954","2020-10-21","18:00:00","" "1504454","4.899","0.001","14.244","0.001","10.241","0.001","90","","92.81","0.01","90","","713.77","0.17","295","2","295","2","","","","","","","","3","P 1 21 1","P 2yb","4","","4-(4,6-dihydroxy-2-cyclohexenyl)oxy- 6-(hydroxymethyl)cyclohexane-1,2,3-triol","","- C12 H20 O8 -","- C12 H20 O8 -","- C24 H40 O16 -","2","1","","Chai, Xing Yun; Song, Yue Lin; Xu, Zheng Ren; Shi, Hai Ming; Bai, Chang Cai; Bi, Dan; Wen, Jing; Li, Fei Fei; Tu, Peng Fei","Itosides J-N from Itoa orientalis and structure - anti-COX-2 activity relationship of phenolic glycosides.","Journal of natural products","2008","71","5","814","819","10.1021/np800014s","","","0.71073","MoKα","","0.0411","0.0402","","","0.1077","0.1097","","","","","","1.064","","","","has coordinates","201954","2020-10-21","18:00:00","" "1504455","10.215","0.004","12.6695","0.0012","13.163","0.002","90","","102.65","0.04","90","","1662.2","0.8","120","2","120","2","","","","","","","'natural product isolated from Nepeta parnassica'","3","P 1 21/c 1","-P 2ybc","14","none","(1R,2R,3R,8S,9S,10S)-3,7,10,14-tetramethyl-15,17-dioxapentacyclo [7.5.2.2^2,8^.0^2,6^.0^9,13^]octadeca-6,13-diene-16,18-dione","","- C20 H24 O4 -","- C20 H24 O4 -","- C80 H96 O16 -","4","1","","Gkinis, Giorgos; Ioannou, Efstathia; Quesada, Antonio; Vagias, Constantinos; Tzakou, Olga; Roussis, Vassilios","Parnapimarol and nepetaparnone from Nepeta parnassica.","Journal of natural products","2008","71","5","926","928","10.1021/np800043b","","","0.7107","MoKα","","0.0998","0.0598","","","0.1373","0.1596","","","","","","1.039","","","","has coordinates","176432","2020-10-21","18:00:00","" "1504456","9.801","0.004","11.207","0.004","26.272","0.01","90","","90","","90","","2885.7","1.9","298","2","298","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C32 H39 Br O5 -","- C32 H39 Br O5 -","- C128 H156 Br4 O20 -","4","1","","Du, Lin; Zhu, Tianjiao; Fang, Yuchun; Gu, Qianqun; Zhu, Weiming","Unusual C25 steroid isomers with bicyclo[4.4.1]A/B rings from a volcano ash-derived fungus Penicillium citrinum.","Journal of natural products","2008","71","8","1343","1351","10.1021/np8000442","","","0.71073","MoKα","","0.1059","0.0428","","","0.0724","0.0806","","","","","","0.998","","","","has coordinates","176729","2020-10-21","18:00:00","" "1504457","9.772","0.004","11.108","0.005","26.28","0.011","90","","90","","90","","2853","2","298","2","298","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C32 H39 Br O5 -","- C32 H39 Br O5 -","- C128 H156 Br4 O20 -","4","1","","Du, Lin; Zhu, Tianjiao; Fang, Yuchun; Gu, Qianqun; Zhu, Weiming","Unusual C25 steroid isomers with bicyclo[4.4.1]A/B rings from a volcano ash-derived fungus Penicillium citrinum.","Journal of natural products","2008","71","8","1343","1351","10.1021/np8000442","","","0.71073","MoKα","","0.0945","0.0455","","","0.0973","0.1113","","","","","","1","","","","has coordinates","176729","2020-10-21","18:00:00","" "1504458","6.6828","0.0013","10.1709","0.0016","33.541","0.003","90","","90","","90","","2279.8","0.6","298","2","298","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C25 H36 O4 -","- C25 H36 O4 -","- C100 H144 O16 -","4","1","","Du, Lin; Zhu, Tianjiao; Fang, Yuchun; Gu, Qianqun; Zhu, Weiming","Unusual C25 steroid isomers with bicyclo[4.4.1]A/B rings from a volcano ash-derived fungus Penicillium citrinum.","Journal of natural products","2008","71","8","1343","1351","10.1021/np8000442","","","0.71073","MoKα","","0.0768","0.0487","","","0.1016","0.1096","","","","","","0.998","","","","has coordinates","176729","2020-10-21","18:00:00","" "1504459","8.799","0.002","14.981","0.003","15.655","0.003","90","","90","","90","","2063.6","0.7","295","2","295","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C23 H35 N O5 -","- C23 H35 N O5 -","- C92 H140 N4 O20 -","4","1","","Li, Chun-Shun; Di, Ying-Tong; Mu, Shu-Zhen; He, Hong-Ping; Zhang, Qiang; Fang, Xin; Zhang, Yu; Li, Shun-Lin; Lu, Yang; Gong, Yan-Qing; Hao, Xiao-Jiang","Daphniphyllum and diterpenoid alkaloids from Daphniphyllum longeracemosum.","Journal of natural products","2008","71","7","1202","1206","10.1021/np8001332","","","0.71073","MoKα","","0.0399","0.0368","","","0.0993","0.1026","","","","","","1.05","","","","has coordinates","176729","2020-10-21","18:00:00","" "1504460","8.6602","0.0004","10.0129","0.0004","10.7964","0.0004","73.781","0.002","68.704","0.003","72.799","0.002","817.57","0.06","100","","100","","","","","","","","Extracted from Nigella sativa Linn.","5","P -1","-P 1","2","Nigellidine sulphate","11-(4-hydroxyphenyl)-3-methyl-6,7,8,9-tetrahydropyridazino [1,2-a]indazol-10-ium-1-yl sulfate","","- C18 H18 N2 O5 S -","- C18 H18 N2 O5 S -","- C36 H36 N4 O10 S2 -","2","1","","Ali, Zulfiqar; Ferreira, Daneel; Carvalho, Paulo; Avery, Mitchell A.; Khan, Ikhlas A.","Nigellidine-4-O-sulfite, the first sulfated indazole-type alkaloid from the seeds of Nigella sativa","Journal of natural products","2008","71","6","1111","1112","10.1021/np800172x","","","1.54178","CuKα","","0.0354","0.0335","","","0.0894","0.0906","","","","","","1.067","","","","has coordinates","201954","2020-10-21","18:00:00","" "1504461","7.817","0.001","12.2016","0.0001","26.9623","0.0001","90","","90","","90","","2571.7","0.3","100","2","100","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C30 H34 O6 -","- C30 H34 O6 -","- C120 H136 O24 -","4","1","","He, Lan; Hou, Jing; Gan, Maoluo; Shi, Jiangong; Chantrapromma, Suchada; Fun, Hoong-Kun; Williams, Ian D.; Sung, Herman H.-Y.","Cadinane sesquiterpenes from the leaves of Eupatorium adenophorum.","Journal of natural products","2008","71","8","1485","1488","10.1021/np800242w","","","1.54184","CuKα","","0.0285","0.0281","","","0.0732","0.0735","","","","","","1.004","","","","has coordinates","176729","2020-10-21","18:00:00","" "1504462","5.5585","0.0001","14.6312","0.0002","17.8717","0.0002","90","","90","","90","","1453.46","0.04","173","2","173","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C15 H26 O2 -","- C15 H26 O2 -","- C60 H104 O8 -","4","1","","He, Lan; Hou, Jing; Gan, Maoluo; Shi, Jiangong; Chantrapromma, Suchada; Fun, Hoong-Kun; Williams, Ian D.; Sung, Herman H.-Y.","Cadinane sesquiterpenes from the leaves of Eupatorium adenophorum.","Journal of natural products","2008","71","8","1485","1488","10.1021/np800242w","","","1.54184","CuKα","","0.0302","0.0281","","","0.0762","0.0779","","","","","","1.056","","","","has coordinates","201954","2020-10-21","18:00:00","" "1504463","14.058","0.002","14.058","0.002","15.624","0.003","90","","90","","120","","2674.1","0.7","293","2","293","2","","","","","","","","3","P 65","P 65","170","","","","- C15 H20 O4 -","- C15 H20 O4 -","- C90 H120 O24 -","6","1","","He, Lan; Hou, Jing; Gan, Maoluo; Shi, Jiangong; Chantrapromma, Suchada; Fun, Hoong-Kun; Williams, Ian D.; Sung, Herman H.-Y.","Cadinane sesquiterpenes from the leaves of Eupatorium adenophorum.","Journal of natural products","2008","71","8","1485","1488","10.1021/np800242w","","","0.71073","MoKα","","0.0941","0.045","","","0.0954","0.0998","","","","","","0.975","","","","has coordinates","176729","2020-10-21","18:00:00","" "1504464","13.4595","0.0002","6.7872","0.0001","20.1461","0.0003","90","","104.785","0.001","90","","1779.46","0.05","296","2","296","2","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C36 H60 O10 -","- C36 H62 O11 -","- C72 H124 O22 -","2","1","","Fu, Xiang; Li, Xing-Cong; Smillie, Troy J.; Carvalho, Paulo; Mabusela, Wilfred; Syce, James; Johnson, Quinton; Folk, William; Avery, Mitchell A.; Khan, Ikhlas A.","Cycloartane glycosides from Sutherlandia frutescens.","Journal of natural products","2008","71","10","1749","1753","10.1021/np800328r","","","1.54178","CuKα","","0.0669","0.0442","","","0.084","0.0911","","","","","","1.024","","","","has coordinates","176729","2020-10-21","18:00:00","" "1504465","16.4914","0.0018","19.995","0.004","6.399","0.0013","90","","90","","90","","2110","0.6","193","2","193","2","","","","","","","","3","P 21 21 2","P 2 2ab","18","","","","- C23 H36 O3 -","- C23 H36 O3 -","- C92 H144 O12 -","4","1","","Liermann, Johannes C.; Kolshorn, Heinz; Anke, Heidrun; Thines, Eckhard; Opatz, Till","Tetracyclic terpenoids from Dasyscyphus niveus, dasyscyphins D and E.","Journal of natural products","2008","71","9","1654","1656","10.1021/np800355a","","","1.54178","CuKα","","0.1797","0.0978","","","0.2617","0.3326","","","","","","1.068","","","","has coordinates","176729","2020-10-21","18:00:00","" "1504466","9.2866","0.0014","12.216","0.002","9.8166","0.0012","90","","105.172","0.011","90","","1074.8","0.3","298","2","298","2","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C22 H34 O7 -","- C22 H34 O7 -","- C44 H68 O14 -","2","1","","Lu, Yi; Huang, Chiung-Yao; Lin, Yu-Fang; Wen, Zhi-Hong; Su, Jui-Hsin; Kuo, Yao-Haur; Chiang, Michael Y.; Sheu, Jyh-Horng","Anti-inflammatory cembranoids from the soft corals Sinularia querciformis and Sinularia granosa.","Journal of natural products","2008","71","10","1754","1759","10.1021/np8003563","","","0.71073","MoKα","","0.0465","0.0364","","","0.0932","0.0995","","","","","","1.06","","","","has coordinates","201954","2020-10-21","18:00:00","" "1504467","7.9929","0.0012","8.7665","0.0019","10.816","0.004","86.32","0.03","80.07","0.02","63.37","0.013","667.3","0.3","193","2","193","2","","","","","","","","3","P -1","-P 1","2","","","","- C16 H14 O6 -","- C16 H14 O6 -","- C32 H28 O12 -","2","1","","Opatz, Till; Kolshorn, Heinz; Thines, Eckhard; Anke, Heidrun","Ascomycones A-C, heptaketide metabolites from an unidentified ascomycete.","Journal of natural products","2008","71","11","1973","1976","10.1021/np800570w","","","1.54178","CuKα","","0.1005","0.0764","","","0.2025","0.2314","","","","","","1.061","","","","has coordinates","201954","2020-10-21","18:00:00","" "1504468","8.0031","0.0004","17.5926","0.0006","10.8678","0.0006","90","","107.005","0.005","90","","1463.24","0.13","193","2","193","2","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C16 H16 O7 -","- C16 H16 O7 -","- C64 H64 O28 -","4","2","","Opatz, Till; Kolshorn, Heinz; Thines, Eckhard; Anke, Heidrun","Ascomycones A-C, heptaketide metabolites from an unidentified ascomycete.","Journal of natural products","2008","71","11","1973","1976","10.1021/np800570w","","","1.54178","CuKα","","0.1242","0.0814","","","0.2312","0.2763","","","","","","1.04","","","","has coordinates","176729","2020-10-21","18:00:00","" "1516493","11.2062","0.0013","12.595","0.0014","12.8803","0.0015","90","","90","","90","","1818","0.4","571","2","571","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C20 H23 N O6 -","- C20 H23 N O6 -","- C80 H92 N4 O24 -","4","1","","Yan, Meng-Hong; Cheng, Pi; Jiang, Zhi-Yong; Ma, Yun-Bao; Zhang, Xue-Mei; Zhang, Feng-Xue; Yang, Liu-Meng; Zheng, Yong-Tang; Chen, Ji-Jun","Periglaucines A-D, anti-HBV and -HIV-1 alkaloids from Pericampylus glaucus.","Journal of natural products","2008","71","5","760","763","10.1021/np070479+","","","0.71073","MoKα","","0.0968","0.0577","","","0.1339","0.1522","","","","","","1.18","","","","has coordinates","176729","2020-10-21","18:00:00",""