# Search results of SQL query from the Crystallography Open Database
# Date and time performed: 2024-06-26T20:16:47+02:00
# 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 = 79 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
"1540710","8.464","0.0003","15.4214","0.0005","19.4594","0.0007","90","","90","","90","","2539.97","0.15","100","2","100","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C26 H30 O9 -","- C26 H30 O9 -","- C104 H120 O36 -","4","1","","Wang, Wei-Guang; Li, Ao; Yan, Bing-Chao; Niu, Shu-Bin; Tang, Jian-Wei; Li, Xiao-Nian; Du, Xue; Challis, Gregory L.; Che, Yongsheng; Sun, Han-Dong; Pu, Jian-Xin","LC-MS-Guided Isolation of Penicilfuranone A: A New Antifibrotic Furancarboxylic Acid from the Plant Endophytic Fungus Penicillium sp. sh18.","Journal of natural products","2016","79","1","149","155","10.1021/acs.jnatprod.5b00814","","","1.54178","CuKα","","0.054","0.0521","","","0.1648","0.1741","","","","","","1.046","","","","has coordinates","175791","2020-10-21","18:00:00",""
"1540720","7.234","0.001","10.321","0.001","19.308","0.002","85.37","0.01","79.85","0.02","69.87","0.01","1332","0.3","173","2","173","2","","","","","","","","3","P 1","P 1","1","","","","- C27 H38 O4 -","- C27 H38 O4 -","- C54 H76 O8 -","2","2","","Cimmino, Alessio; Mathieu, Veronique; Masi, Marco; Baroncelli, Riccardo; Boari, Angela; Pescitelli, Gennaro; Ferderin, Marlène; Lisy, Romana; Evidente, Marco; Tuzi, Angela; Zonno, Maria Chiara; Kornienko, Alexander; Kiss, Robert; Evidente, Antonio","Higginsianins A and B, Two Diterpenoid α-Pyrones Produced by Colletotrichum higginsianum, with in Vitro Cytostatic Activity.","Journal of natural products","2016","79","1","116","125","10.1021/acs.jnatprod.5b00779","","","0.71073","MoKα","","0.2219","0.1026","","","0.2105","0.2528","","","","","","0.896","","","","has coordinates","175794","2020-10-21","18:00:00",""
"1540723","11.738","0.003","13.856","0.003","17.106","0.003","90","","90","","90","","2782.1","1.1","173","2","173","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C31 H48 O4 -","- C31 H48 O4 -","- C124 H192 O16 -","4","1","","Xu, Jing; Kang, Jing; Sun, Xiaocong; Cao, Xiangrong; Rena, Kasimu; Lee, Dongho; Ren, Quanhui; Li, Shen; Ohizumi, Yasushi; Guo, Yuanqiang","Di- and Triterpenoids from the Leaves of Casearia balansae and Neurite Outgrowth Promoting Effects of PC12 Cells.","Journal of natural products","2016","79","1","170","179","10.1021/acs.jnatprod.5b00815","","","1.54187","CuKα","","0.0501","0.0424","","","0.1094","0.1145","","","","","","1.028","","","","has coordinates","175793","2020-10-21","18:00:00",""
"1540726","8.6391","0.0001","7.926","0.0001","11.5438","0.0002","90","","98.41","0.001","90","","781.945","0.019","100","2","100","2","","","","","","","","4","P 1 21 1","P 2yb","4","(-)-19(R)-hydroxyeburnamenine","","","- C19 H22 N2 O -","- C19 H22 N2 O -","- C38 H44 N4 O2 -","2","1","","Yap, Wai-Sum; Gan, Chew-Yan; Sim, Kae-Shin; Lim, Siew-Huah; Low, Yun-Yee; Kam, Toh-Seok","Aspidofractinine and Eburnane Alkaloids from a North Borneo Kopsia. Ring-Contracted, Additional Ring-Fused, and Paucidactine-Type Aspidofractinine Alkaloids from K. pauciflora.","Journal of natural products","2016","79","1","230","239","10.1021/acs.jnatprod.5b00992","","","0.71073","MoKα","","0.0514","0.0419","","","0.0918","0.1068","","","","","","1.071","","","","has coordinates","175792","2020-10-21","18:00:00",""
"1540727","14.2796","0.0004","7.9986","0.0002","15.778","0.0005","90","","116.781","0.002","90","","1608.81","0.08","173","2","173","2","","","","","","","","4","P 1 21 1","P 2yb","4","Larutienine B","","","- C19 H22 N2 O2 -","- C19 H22 N2 O2 -","- C76 H88 N8 O8 -","4","2","","Yap, Wai-Sum; Gan, Chew-Yan; Sim, Kae-Shin; Lim, Siew-Huah; Low, Yun-Yee; Kam, Toh-Seok","Aspidofractinine and Eburnane Alkaloids from a North Borneo Kopsia. Ring-Contracted, Additional Ring-Fused, and Paucidactine-Type Aspidofractinine Alkaloids from K. pauciflora.","Journal of natural products","2016","79","1","230","239","10.1021/acs.jnatprod.5b00992","","","0.71073","MoKα","","0.064","0.0473","","","0.0948","0.1004","","","","","","0.917","","","","has coordinates","175792","2020-10-21","18:00:00",""
"1540728","9.9492","0.0005","8.2037","0.0004","13.0494","0.0007","90","","109.845","0.003","90","","1001.84","0.09","100","2","100","2","","","","","","","","4","P 1 21 1","P 2yb","4","Paucidactinine","","","- C23 H24 N2 O7 -","- C23 H24 N2 O7 -","- C46 H48 N4 O14 -","2","1","","Yap, Wai-Sum; Gan, Chew-Yan; Sim, Kae-Shin; Lim, Siew-Huah; Low, Yun-Yee; Kam, Toh-Seok","Aspidofractinine and Eburnane Alkaloids from a North Borneo Kopsia. Ring-Contracted, Additional Ring-Fused, and Paucidactine-Type Aspidofractinine Alkaloids from K. pauciflora.","Journal of natural products","2016","79","1","230","239","10.1021/acs.jnatprod.5b00992","","","0.71073","MoKα","","0.0664","0.0535","","","0.1226","0.1282","","","","","","1.037","","","","has coordinates","175792","2020-10-21","18:00:00",""
"1540729","6.7581","0.0002","11.4548","0.0003","23.3157","0.0006","90","","90","","90","","1804.93","0.09","100","2","100","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","Paucidirinine","","","- C21 H26 N2 O4 -","- C21 H26 N2 O4 -","- C84 H104 N8 O16 -","4","1","","Yap, Wai-Sum; Gan, Chew-Yan; Sim, Kae-Shin; Lim, Siew-Huah; Low, Yun-Yee; Kam, Toh-Seok","Aspidofractinine and Eburnane Alkaloids from a North Borneo Kopsia. Ring-Contracted, Additional Ring-Fused, and Paucidactine-Type Aspidofractinine Alkaloids from K. pauciflora.","Journal of natural products","2016","79","1","230","239","10.1021/acs.jnatprod.5b00992","","","0.71073","MoKα","","0.043","0.0361","","","0.0885","0.0994","","","","","","1.073","","","","has coordinates","175792","2020-10-21","18:00:00",""
"1540730","6.662","0.0004","9.811","0.0005","34.444","0.0018","90","","90","","90","","2251.3","0.2","100","2","100","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","Paucidirisine","","","- C25 H28 Cl2 N2 O3 -","- C25 H28 Cl2 N2 O3 -","- C100 H112 Cl8 N8 O12 -","4","1","","Yap, Wai-Sum; Gan, Chew-Yan; Sim, Kae-Shin; Lim, Siew-Huah; Low, Yun-Yee; Kam, Toh-Seok","Aspidofractinine and Eburnane Alkaloids from a North Borneo Kopsia. Ring-Contracted, Additional Ring-Fused, and Paucidactine-Type Aspidofractinine Alkaloids from K. pauciflora.","Journal of natural products","2016","79","1","230","239","10.1021/acs.jnatprod.5b00992","","","0.71073","MoKα","","0.1258","0.06","","","0.1277","0.1664","","","","","","0.853","","","","has coordinates","175792","2020-10-21","18:00:00",""
"1540731","8.4666","0.0003","12.1895","0.0004","16.9938","0.0006","90","","90","","90","","1753.82","0.1","100","2","100","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","(-)-19(R)-hydroxy-O-ethylisoeburnamine","","","- C21 H28 N2 O2 -","- C21 H28 N2 O2 -","- C84 H112 N8 O8 -","4","1","","Yap, Wai-Sum; Gan, Chew-Yan; Sim, Kae-Shin; Lim, Siew-Huah; Low, Yun-Yee; Kam, Toh-Seok","Aspidofractinine and Eburnane Alkaloids from a North Borneo Kopsia. Ring-Contracted, Additional Ring-Fused, and Paucidactine-Type Aspidofractinine Alkaloids from K. pauciflora.","Journal of natural products","2016","79","1","230","239","10.1021/acs.jnatprod.5b00992","","","0.71073","MoKα","","0.111","0.0603","","","0.0997","0.1151","","","","","","1.022","","","","has coordinates","175792","2020-10-21","18:00:00",""
"1542287","9.873","0.002","7.792","0.0016","11.34","0.002","90","","91.557","0.006","90","","872.1","0.3","100","2","100","2","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C19 H22 O5 -","- C19 H22 O5 -","- C38 H44 O10 -","2","1","","Shaffer, Corena V.; Cai, Shengxin; Peng, Jiangnan; Robles, Andrew J.; Hartley, Rachel M.; Powell, Douglas R.; Du, Lin; Cichewicz, Robert H.; Mooberry, Susan L.","Texas Native Plants Yield Compounds with Cytotoxic Activities against Prostate Cancer Cells.","Journal of natural products","2016","79","3","531","540","10.1021/acs.jnatprod.5b00908","","","1.54178","CuKα","","0.1323","0.1117","","","0.2602","0.2975","","","","","","1.098","","","","has coordinates","181437","2020-10-21","18:00:00",""
"1542314","15.0258","0.0002","15.0258","0.0002","24.0607","0.0007","90","","90","","90","","5432.3","0.19","295","2","295","2","","","","","","","","3","P 41 21 2","P 4abw 2nw","92","","","","- C29 H38 O8 -","- C29 H38 O8 -","- C232 H304 O64 -","8","1","","Chen, Chien-Chih; Tzeng, Tsai-Teng; Chen, Chin-Chu; Ni, Ching-Li; Lee, Li-Ya; Chen, Wan-Ping; Shiao, Young-Ji; Shen, Chien-Chang","Erinacine S, a Rare Sesterterpene from the Mycelia of Hericium erinaceus.","Journal of natural products","2016","79","2","438","441","10.1021/acs.jnatprod.5b00474","","","1.54178","CuKα","","0.0732","0.0508","","","0.1237","0.1403","","","","","","1.025","","","","has coordinates","177412","2020-10-21","18:00:00",""
"1542411","10.4012","0.0003","6.5192","0.0002","12.5869","0.0003","90","","94.667","0.002","90","","850.66","0.04","130","","130","","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C21 H28 O2 -","- C21 H28 O2 -","- C42 H56 O4 -","2","1","","Jiao, Wei-Hua; Shi, Guo-Hua; Xu, Ting-Ting; Chen, Guo-Dong; Gu, Bin-Bin; Wang, Zhuo; Peng, Shuang; Wang, Shu-Ping; Li, Jia; Han, Bing-Nan; Zhang, Wei; Lin, Hou-Wen","Dysiherbols A-C and Dysideanone E, Cytotoxic and NF-κB Inhibitory Tetracyclic Meroterpenes from a Dysidea sp. Marine Sponge.","Journal of natural products","2016","79","2","406","411","10.1021/acs.jnatprod.5b01079","","","1.54178","CuKα","","0.0467","0.0441","","","0.1295","0.1378","","","","","","1.085","","","","has coordinates","177413","2020-10-21","18:00:00",""
"1542562","9.7421","0.0002","9.7391","0.0002","16.0471","0.0003","90","","90","","90","","1522.54","0.05","298","2","298","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C17 H21.3 N O4.15 -","- C17 H21.3 N O4.15 -","- C68 H85.2 N4 O16.6 -","4","1","","Zhan, Guanqun; Zhou, Junfei; Liu, Rong; Liu, Tingting; Guo, Guoli; Wang, Jianping; Xiang, Ming; Xue, Yongbo; Luo, Zengwei; Zhang, Yonghui; Yao, Guangmin","Galanthamine, Plicamine, and Secoplicamine Alkaloids from Zephyranthes candida and Their Anti-acetylcholinesterase and Anti-inflammatory Activities.","Journal of natural products","2016","79","4","760","766","10.1021/acs.jnatprod.5b00681","","","1.54178","CuKα","","0.029","0.0289","","","0.0798","0.0799","","","","","","1.068","","","","has coordinates,has disorder","183579","2020-10-21","18:00:00",""
"1542563","8.0372","0.0001","15.6818","0.0002","22.5648","0.0003","90","","90","","90","","2844.02","0.06","298","2","298","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C16 H22 N O4.5 -","- C16 H22 N O4.5 -","- C128 H176 N8 O36 -","8","2","","Zhan, Guanqun; Zhou, Junfei; Liu, Rong; Liu, Tingting; Guo, Guoli; Wang, Jianping; Xiang, Ming; Xue, Yongbo; Luo, Zengwei; Zhang, Yonghui; Yao, Guangmin","Galanthamine, Plicamine, and Secoplicamine Alkaloids from Zephyranthes candida and Their Anti-acetylcholinesterase and Anti-inflammatory Activities.","Journal of natural products","2016","79","4","760","766","10.1021/acs.jnatprod.5b00681","","","1.54178","CuKα","","0.0595","0.044","","","0.1382","0.1976","","","","","","1.163","","","","has coordinates","183579","2020-10-21","18:00:00",""
"1542564","9.4965","0.0002","11.4906","0.0003","9.9133","0.0003","90","","95.247","0.001","90","","1077.21","0.05","298","2","298","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C23 H30.01 N2 O4 -","- C23.004 H30.011 N2 O4 -","- C46.008 H60.022 N4 O8 -","2","1","","Zhan, Guanqun; Zhou, Junfei; Liu, Rong; Liu, Tingting; Guo, Guoli; Wang, Jianping; Xiang, Ming; Xue, Yongbo; Luo, Zengwei; Zhang, Yonghui; Yao, Guangmin","Galanthamine, Plicamine, and Secoplicamine Alkaloids from Zephyranthes candida and Their Anti-acetylcholinesterase and Anti-inflammatory Activities.","Journal of natural products","2016","79","4","760","766","10.1021/acs.jnatprod.5b00681","","","1.54178","CuKα","","0.0441","0.0424","","","0.1192","0.1216","","","","","","1.069","","","","has coordinates,has disorder","183579","2020-10-21","18:00:00",""
"1542565","9.6195","0.0002","11.6392","0.0002","9.6441","0.0001","90","","94.229","0.001","90","","1076.85","0.03","298","2","298","2","","","","","","","","4","P 1 21 1","P 2yb","4","","","","- C23 H30 N2 O4 -","- C23 H30 N2 O4 -","- C46 H60 N4 O8 -","2","1","","Zhan, Guanqun; Zhou, Junfei; Liu, Rong; Liu, Tingting; Guo, Guoli; Wang, Jianping; Xiang, Ming; Xue, Yongbo; Luo, Zengwei; Zhang, Yonghui; Yao, Guangmin","Galanthamine, Plicamine, and Secoplicamine Alkaloids from Zephyranthes candida and Their Anti-acetylcholinesterase and Anti-inflammatory Activities.","Journal of natural products","2016","79","4","760","766","10.1021/acs.jnatprod.5b00681","","","1.54178","CuKα","","0.0451","0.0418","","","0.1131","0.1161","","","","","","1.047","","","","has coordinates","183579","2020-10-21","18:00:00",""
"1542566","7.9947","0.0002","8.6002","0.0002","24.7362","0.0005","90","","90","","90","","1700.76","0.07","298","2","298","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C18 H27 N O5 -","- C18 H27 N O5 -","- C72 H108 N4 O20 -","4","1","","Zhan, Guanqun; Zhou, Junfei; Liu, Rong; Liu, Tingting; Guo, Guoli; Wang, Jianping; Xiang, Ming; Xue, Yongbo; Luo, Zengwei; Zhang, Yonghui; Yao, Guangmin","Galanthamine, Plicamine, and Secoplicamine Alkaloids from Zephyranthes candida and Their Anti-acetylcholinesterase and Anti-inflammatory Activities.","Journal of natural products","2016","79","4","760","766","10.1021/acs.jnatprod.5b00681","","","1.54178","CuKα","","0.0558","0.0487","","","0.1348","0.1364","","","","","","1.052","","","","has coordinates","183579","2020-10-21","18:00:00",""
"1542618","7.5013","0.0001","11.6919","0.0002","14.619","0.0002","90","","103.882","0.001","90","","1244.7","0.03","140","2","140","2","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C27 H32 O8 -","- C27 H32 O8 -","- C54 H64 O16 -","2","1","","Wang, Guo-Cai; Yu, Jin-Hai; Shen, Yu; Leng, Ying; Zhang, Hua; Yue, Jian-Min","Limonoids and Triterpenoids as 11β-HSD1 Inhibitors from Walsura robusta.","Journal of natural products","2016","79","4","899","906","10.1021/acs.jnatprod.5b00952","","","1.54178","CuKα","","0.0424","0.0423","","","0.1051","0.1053","","","","","","1.062","","","","has coordinates","183583","2020-10-21","18:00:00",""
"1542619","7.4553","0.0002","12.0869","0.0004","28.1295","0.0007","90","","90.18","0.002","90","","2534.78","0.13","296","2","296.15","","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C27 H34 O8 -","- C27 H34 O8 -","- C108 H136 O32 -","4","2","","Wang, Guo-Cai; Yu, Jin-Hai; Shen, Yu; Leng, Ying; Zhang, Hua; Yue, Jian-Min","Limonoids and Triterpenoids as 11β-HSD1 Inhibitors from Walsura robusta.","Journal of natural products","2016","79","4","899","906","10.1021/acs.jnatprod.5b00952","","","1.54178","CuKα","","0.0477","0.0432","","","0.1106","0.1147","","","","","","1.025","","","","has coordinates","183583","2020-10-21","18:00:00",""
"1542761","15.775","0.005","7.137","0.003","16.382","0.005","90","","107.97","0.03","90","","1754.4","1.1","293","2","293","2","","","","","","","","5","P 1 21 1","P 2yb","4","","","","- C15 H19 Br2 Cl O3 -","- C15 H19 Br2 Cl O3 -","- C60 H76 Br8 Cl4 O12 -","4","2","","Gutiérrez-Cepeda, Adrián; Fernández, José J; Norte, Manuel; López-Rodríguez, Matías; Brito, Iván; Muller, Christian D.; Souto, María L","Additional Insights into the Obtusallene Family: Components of Laurencia marilzae.","Journal of natural products","2016","79","4","1184","1188","10.1021/acs.jnatprod.5b01080","","","1.5418","CuKα","","0.0846","0.0647","","","0.1704","0.2058","","","","","","0.995","","","","has coordinates","183581","2020-10-21","18:00:00",""
"1542762","5.3218","0.0004","14.7425","0.0008","21.8252","0.0014","90","","90","","90","","1712.33","0.19","100","2","100","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C20 H31 N3 O -","- C20 H31 N3 O -","- C80 H124 N12 O4 -","4","1","","Li, Xiao-Hui; Zhang, Yu; Zhang, Jia-Hui; Li, Xiao-Nian; Cao, Ming-Ming; Di, Ying-Tong; Peng, Zong-Gen; Jiang, Jian-Dong; Hao, Xiao-Jiang","Myritonines A-C, Alkaloids from Myrioneuron tonkinensis Based on a Novel Hexacyclic Skeleton.","Journal of natural products","2016","79","4","1203","1207","10.1021/acs.jnatprod.5b01130","","","1.54178","CuKα","","0.0922","0.0727","","","0.206","0.2251","","","","","","1.215","","","","has coordinates","183582","2020-10-21","18:00:00",""
"1542763","5.4602","0.0004","17.7085","0.0015","18.1951","0.0015","90","","90","","90","","1759.3","0.2","296","2","296","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C20 H33 N3 -","- C20 H33 N3 -","- C80 H132 N12 -","4","1","","Li, Xiao-Hui; Zhang, Yu; Zhang, Jia-Hui; Li, Xiao-Nian; Cao, Ming-Ming; Di, Ying-Tong; Peng, Zong-Gen; Jiang, Jian-Dong; Hao, Xiao-Jiang","Myritonines A-C, Alkaloids from Myrioneuron tonkinensis Based on a Novel Hexacyclic Skeleton.","Journal of natural products","2016","79","4","1203","1207","10.1021/acs.jnatprod.5b01130","","","1.54178","CuKα","","0.2544","0.1025","","","0.2314","0.3373","","","","","","0.88","","","","has coordinates","183582","2020-10-21","18:00:00",""
"1542905","11.5247","0.0006","12.6097","0.0006","18.36","0.001","90","","90","","90","","2668.1","0.2","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C27 H44 O7 -","- C27 H44 O7 -","- C108 H176 O28 -","4","1","","Liu, Hui; Li, Xiao-Ming; Liu, Yang; Zhang, Peng; Wang, Jia-Ning; Wang, Bin-Gui","Chermesins A-D: Meroterpenoids with a Drimane-Type Spirosesquiterpene Skeleton from the Marine Algal-Derived Endophytic Fungus Penicillium chermesinum EN-480.","Journal of natural products","2016","79","4","806","811","10.1021/acs.jnatprod.5b00893","","","1.54178","CuKα","","0.0742","0.0534","","","0.1171","0.1312","","","","","","1.018","","","","has coordinates","183584","2020-10-21","18:00:00",""
"1542906","8.4475","0.0007","10.3954","0.0009","24.175","0.002","90","","90","","90","","2122.9","0.3","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C24 H34 O3 -","- C24 H34 O3 -","- C96 H136 O12 -","4","1","","Liu, Hui; Li, Xiao-Ming; Liu, Yang; Zhang, Peng; Wang, Jia-Ning; Wang, Bin-Gui","Chermesins A-D: Meroterpenoids with a Drimane-Type Spirosesquiterpene Skeleton from the Marine Algal-Derived Endophytic Fungus Penicillium chermesinum EN-480.","Journal of natural products","2016","79","4","806","811","10.1021/acs.jnatprod.5b00893","","","1.54178","CuKα","","0.1024","0.0589","","","0.1085","0.1332","","","","","","1.009","","","","has coordinates","183584","2020-10-21","18:00:00",""
"1542907","8.6259","0.0005","9.3446","0.0005","27.3784","0.0014","90","","90","","90","","2206.9","0.2","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C24 H36 O3 -","- C24 H36 O3 -","- C96 H144 O12 -","4","1","","Liu, Hui; Li, Xiao-Ming; Liu, Yang; Zhang, Peng; Wang, Jia-Ning; Wang, Bin-Gui","Chermesins A-D: Meroterpenoids with a Drimane-Type Spirosesquiterpene Skeleton from the Marine Algal-Derived Endophytic Fungus Penicillium chermesinum EN-480.","Journal of natural products","2016","79","4","806","811","10.1021/acs.jnatprod.5b00893","","","1.54178","CuKα","","0.0599","0.0476","","","0.1144","0.123","","","","","","1.048","","","","has coordinates","183584","2020-10-21","18:00:00",""
"1542908","8.0099","0.0005","8.5188","0.0004","35.9835","0.0018","90","","90","","90","","2455.3","0.2","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C26 H38 O6 -","- C26 H38 O6 -","- C104 H152 O24 -","4","1","","Liu, Hui; Li, Xiao-Ming; Liu, Yang; Zhang, Peng; Wang, Jia-Ning; Wang, Bin-Gui","Chermesins A-D: Meroterpenoids with a Drimane-Type Spirosesquiterpene Skeleton from the Marine Algal-Derived Endophytic Fungus Penicillium chermesinum EN-480.","Journal of natural products","2016","79","4","806","811","10.1021/acs.jnatprod.5b00893","","","1.54178","CuKα","","0.0507","0.0448","","","0.1163","0.1211","","","","","","1.045","","","","has coordinates","183584","2020-10-21","18:00:00",""
"1543045","29.815","0.016","4.718","0.002","8.617","0.005","90","","90","","90","","1212.1","1.1","120","2","120","2","","","","","","","","4","P c a 21","P 2c -2ac","29","","","","- C14 H12 N4 O2 -","- C14 H12 N4 O2 -","- C56 H48 N16 O8 -","4","1","","Wang, Huan; Hesek, Dusan; Lee, Mijoon; Lastochkin, Elena; Oliver, Allen G.; Chang, Mayland; Mobashery, Shahriar","The Natural Product Essramycin and Three of Its Isomers Are Devoid of Antibacterial Activity.","Journal of natural products","2016","79","4","1219","1222","10.1021/acs.jnatprod.6b00057","","","0.71073","MoKα","","0.0823","0.0569","","","0.125","0.1327","","","","","","1.042","","","","has coordinates","183580","2020-10-21","18:00:00",""
"1543046","5.5805","0.0002","8.5947","0.0004","25.896","0.0011","90","","93.211","0.002","90","","1240.09","0.09","120","2","120","2","","","","","","","","4","P 1 21/n 1","-P 2yn","14","","","","- C14 H12 N4 O2 -","- C14 H12 N4 O2 -","- C56 H48 N16 O8 -","4","1","","Wang, Huan; Hesek, Dusan; Lee, Mijoon; Lastochkin, Elena; Oliver, Allen G.; Chang, Mayland; Mobashery, Shahriar","The Natural Product Essramycin and Three of Its Isomers Are Devoid of Antibacterial Activity.","Journal of natural products","2016","79","4","1219","1222","10.1021/acs.jnatprod.6b00057","","","1.54184","CuKα","","0.0453","0.0432","","","0.1145","0.1158","","","","","","1.086","","","","has coordinates","183580","2020-10-21","18:00:00",""
"1543047","11.0776","0.0012","15.1099","0.0016","7.6255","0.0008","90","","108","0.001","90","","1213.9","0.2","120","2","120","2","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","","","","- C14 H12 N4 O2 -","- C14 H12 N4 O2 -","- C56 H48 N16 O8 -","4","1","","Wang, Huan; Hesek, Dusan; Lee, Mijoon; Lastochkin, Elena; Oliver, Allen G.; Chang, Mayland; Mobashery, Shahriar","The Natural Product Essramycin and Three of Its Isomers Are Devoid of Antibacterial Activity.","Journal of natural products","2016","79","4","1219","1222","10.1021/acs.jnatprod.6b00057","","","0.71073","MoKα","","0.0385","0.036","","","0.0975","0.1001","","","","","","1.036","","","","has coordinates","183580","2020-10-21","18:00:00",""
"1543109","9.0098","0.0006","7.1744","0.0005","14.3213","0.001","90","","92.2","0.005","90","","925.05","0.11","100","2","100","2","","","","","","","","4","P 1 21 1","P 2yb","4","Apocidine A","","","- C21 H24 N2 O4 -","- C21 H24 N2 O4 -","- C42 H48 N4 O8 -","2","1","","Nge, Choy-Eng; Chong, Kam-Weng; Thomas, Noel F.; Lim, Siew-Huah; Low, Yun-Yee; Kam, Toh-Seok","Ibogan, Aspidosperman, Vincamine, and Bisindole Alkaloids from a Malayan Tabernaemontana corymbosa: Iboga Alkaloids with C-20α Substitution.","Journal of natural products","2016","79","5","1388","1399","10.1021/acs.jnatprod.6b00129","","","0.71073","MoKα","","0.0717","0.0495","","","0.0951","0.113","","","","","","1.054","","","","has coordinates","183588","2020-10-21","18:00:00",""
"1543110","6.575","0.0004","14.273","0.0008","19.3071","0.001","90","","90","","90","","1811.87","0.18","100","2","100","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","Conodusine C","","","- C20 H28 N2 O4 -","- C20 H28 N2 O4 -","- C80 H112 N8 O16 -","4","1","","Nge, Choy-Eng; Chong, Kam-Weng; Thomas, Noel F.; Lim, Siew-Huah; Low, Yun-Yee; Kam, Toh-Seok","Ibogan, Aspidosperman, Vincamine, and Bisindole Alkaloids from a Malayan Tabernaemontana corymbosa: Iboga Alkaloids with C-20α Substitution.","Journal of natural products","2016","79","5","1388","1399","10.1021/acs.jnatprod.6b00129","","","0.71073","MoKα","","0.0784","0.0498","","","0.0994","0.1155","","","","","","1.021","","","","has coordinates","183588","2020-10-21","18:00:00",""
"1543111","10.1845","0.0018","10.1845","0.0018","14.613","0.003","90","","90","","90","","1515.7","0.5","100","2","100","2","","","","","","","","4","P 41","P 4w","76","Conodusine A","","","- C19 H22 N2 O -","- C19 H22 N2 O -","- C76 H88 N8 O4 -","4","1","","Nge, Choy-Eng; Chong, Kam-Weng; Thomas, Noel F.; Lim, Siew-Huah; Low, Yun-Yee; Kam, Toh-Seok","Ibogan, Aspidosperman, Vincamine, and Bisindole Alkaloids from a Malayan Tabernaemontana corymbosa: Iboga Alkaloids with C-20α Substitution.","Journal of natural products","2016","79","5","1388","1399","10.1021/acs.jnatprod.6b00129","","","0.71073","MoKα","","0.0696","0.0402","","","0.0651","0.0715","","","","","","0.84","","","","has coordinates","183588","2020-10-21","18:00:00",""
"1543147","6.1031","0.0002","8.4657","0.0003","18.0015","0.0006","90","","94.016","0.001","90","","927.8","0.05","100","2","100","2","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C20 H28 O5 -","- C20 H28 O5 -","- C40 H56 O10 -","2","1","","Hu, Linzhen; Xue, Yongbo; Zhang, Jinwen; Zhu, Hucheng; Chen, Chunmei; Li, Xiao-Nian; Liu, Junjun; Wang, Zhenzhen; Zhang, Yu; Zhang, Yonghui","(±)-Japonicols A-D, Acylphloroglucinol-Based Meroterpenoid Enantiomers with Anti-KSHV Activities from Hypericum japonicum.","Journal of natural products","2016","79","5","1322","1328","10.1021/acs.jnatprod.5b01119","","","1.54178","CuKα","","0.0318","0.0317","","","0.081","0.0811","","","","","","1.054","","","","has coordinates","183585","2020-10-21","18:00:00",""
"1543148","9.9306","0.0012","13.3269","0.0016","14.2698","0.0017","90","","90","","90","","1888.5","0.4","100","2","100","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C20 H30 O6 -","- C20 H30 O6 -","- C80 H120 O24 -","4","1","","Hu, Linzhen; Xue, Yongbo; Zhang, Jinwen; Zhu, Hucheng; Chen, Chunmei; Li, Xiao-Nian; Liu, Junjun; Wang, Zhenzhen; Zhang, Yu; Zhang, Yonghui","(±)-Japonicols A-D, Acylphloroglucinol-Based Meroterpenoid Enantiomers with Anti-KSHV Activities from Hypericum japonicum.","Journal of natural products","2016","79","5","1322","1328","10.1021/acs.jnatprod.5b01119","","","1.54178","CuKα","","0.0322","0.03","","","0.073","0.0832","","","","","","1.06","","","","has coordinates","183585","2020-10-21","18:00:00",""
"1543149","11.6475","0.0011","12.2234","0.0007","15.9268","0.0008","90","","90","","90","","2267.5","0.3","101.8","","101.8","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C25 H28 O7 -","- C25 H28 O7 -","- C100 H112 O28 -","4","1","","Sun, Jing; Zhu, Zhi-Xiang; Song, Yue-Lin; Dong, Dan; Zheng, Jiao; Liu, Ting; Zhao, Yun-Fang; Ferreira, Daneel; Zjawiony, Jordan K.; Tu, Peng-Fei; Li, Jun","Nitric Oxide Inhibitory Meroterpenoids from the Fungus Penicillium purpurogenum MHZ 111.","Journal of natural products","2016","79","5","1415","1422","10.1021/acs.jnatprod.6b00160","","","1.5418","CuKα","","0.0394","0.0377","","","0.096","0.0976","","","","","","1.042","","","","has coordinates","183587","2020-10-21","18:00:00",""
"1543150","12.6572","0.0004","6.67349","0.00019","15.317","0.0005","90","","97.611","0.003","90","","1282.39","0.07","103.3","","103.3","","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C24 H28 O10.79 -","- C24 H28 O10.79 -","- C48 H56 O21.58 -","2","1","","Sun, Jing; Zhu, Zhi-Xiang; Song, Yue-Lin; Dong, Dan; Zheng, Jiao; Liu, Ting; Zhao, Yun-Fang; Ferreira, Daneel; Zjawiony, Jordan K.; Tu, Peng-Fei; Li, Jun","Nitric Oxide Inhibitory Meroterpenoids from the Fungus Penicillium purpurogenum MHZ 111.","Journal of natural products","2016","79","5","1415","1422","10.1021/acs.jnatprod.6b00160","","","1.5418","CuKα","","0.0635","0.0619","","","0.1767","0.179","","","","","","1.064","","","","has coordinates,has disorder","183587","2020-10-21","18:00:00",""
"1543259","5.9126","0.0003","22.9872","0.0019","12.2565","0.0008","90","","90.513","0.001","90","","1665.76","0.19","293","2","293","2","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C19 H26 O3 -","- C19 H26 O3 -","- C38 H52 O6 -","2","1","","Li, Xiao-Dong; Li, Xiao-Ming; Li, Xin; Xu, Gang-Ming; Liu, Yang; Wang, Bin-Gui","Aspewentins D-H, 20-Nor-isopimarane Derivatives from the Deep Sea Sediment-Derived Fungus Aspergillus wentii SD-310.","Journal of natural products","2016","79","5","1347","1353","10.1021/acs.jnatprod.5b01153","","","1.54178","CuKα","","0.1221","0.0838","","","0.2491","0.2967","","","","","","1.1","","","","has coordinates","194547","2020-10-21","18:00:00",""
"1543335","17.138","0.002","9.7525","0.0005","13.831","0.002","90","","134.45","0.03","90","","1650.2","0.9","","","","","","","","","","","","4","P 1","P 1","1","","","","- C18 H17 N O6 -","- C18 H17 N O6 -","- C18 H17 N O6 -","1","1","","Yu, Xuelong; Guo, Qiang; Su, Guozhu; Yang, Ailin; Hu, Zhongdong; Qu, Changhai; Wan, Zhe; Li, Ruoyu; Tu, Pengfei; Chai, Xingyun","Usnic Acid Derivatives with Cytotoxic and Antifungal Activities from the Lichen Usnea longissima.","Journal of natural products","2016","79","5","1373","1380","10.1021/acs.jnatprod.6b00109","","","","","","0.034","","","","","","","","","","","","","","","has coordinates","214153","2020-10-21","18:00:00",""
"1543336","11.6293","0.0002","9.9961","0.0002","16.9428","0.0002","90","","93.84","0.001","90","","1965.14","0.06","","","","","","","","","","","","4","P 1","P 1","1","","","","- C20 H23 N O7 -","- C10 H11.5 N0.5 O3.5 -","- C40 H46 N2 O14 -","4","4","","Yu, Xuelong; Guo, Qiang; Su, Guozhu; Yang, Ailin; Hu, Zhongdong; Qu, Changhai; Wan, Zhe; Li, Ruoyu; Tu, Pengfei; Chai, Xingyun","Usnic Acid Derivatives with Cytotoxic and Antifungal Activities from the Lichen Usnea longissima.","Journal of natural products","2016","79","5","1373","1380","10.1021/acs.jnatprod.6b00109","","","","","","0.034","","","","","","","","","","","","","","","has coordinates","183586","2020-10-21","18:00:00",""
"1543358","6.677","0.0003","14.801","0.0008","15.5028","0.0008","90","","90","","90","","1532.08","0.13","119.2","","119.2","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C15 H24 O4 -","- C15 H24 O4 -","- C60 H96 O16 -","4","1","","Xu, Kuo; Jiang, Jian-Shuang; Feng, Zi-Ming; Yang, Ya-Nan; Li, Li; Zang, Cai-Xia; Zhang, Pei-Cheng","Bioactive Sesquiterpenoid and Polyacetylene Glycosides from Atractylodes lancea.","Journal of natural products","2016","79","6","1567","1575","10.1021/acs.jnatprod.6b00066","","","1.5418","CuKα","","0.0452","0.0398","","","0.0968","0.1017","","","","","","1.03","","","","has coordinates","184935","2020-10-21","18:00:00",""
"1543449","7.5528","0.0002","11.7831","0.0003","14.103","0.0003","90","","90","","90","","1255.1","0.05","90","0.2","90","0.2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C15 H18 O3 -","- C15 H18 O3 -","- C60 H72 O12 -","4","1","","Ordóñez, Paola E; Sharma, Krishan K.; Bystrom, Laura M.; Alas, Maria A.; Enriquez, Raul G.; Malagón, Omar; Jones, Darin E.; Guzman, Monica L.; Compadre, Cesar M.","Dehydroleucodine, a Sesquiterpene Lactone from Gynoxys verrucosa, Demonstrates Cytotoxic Activity against Human Leukemia Cells.","Journal of natural products","2016","79","4","691","696","10.1021/acs.jnatprod.5b00383","","","1.54178","CuKα","","0.0286","0.0284","","","0.0751","0.0753","","","","","","1.054","","","","has coordinates","183540","2020-10-21","18:00:00",""
"1543450","11.7328","0.0001","13.0767","0.0001","19.2454","0.0002","90","","90","","90","","2952.75","0.05","100","2","100","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","Conoduzidine A","","","- C19 H20 N2 O2 -","- C19 H20 N2 O2 -","- C152 H160 N16 O16 -","8","2","","Nge, Choy-Eng; Chong, Kam-Weng; Thomas, Noel F.; Lim, Siew-Huah; Low, Yun-Yee; Kam, Toh-Seok","Ibogan, Aspidosperman, Vincamine, and Bisindole Alkaloids from a Malayan Tabernaemontana corymbosa: Iboga Alkaloids with C-20α Substitution.","Journal of natural products","2016","79","5","1388","1399","10.1021/acs.jnatprod.6b00129","","","1.54184","CuKα","","0.0358","0.0354","","","0.0898","0.0901","","","","","","1.072","","","","has coordinates","183541","2020-10-21","18:00:00",""
"1543601","10.019","0.003","10.019","0.003","42.875","0.012","90","","90","","90","","4304","2","100","2","100","2","","","","","","","","4","P 43","P 4cw","78","","","","- C22 H28 O8 S -","- C22 H28 O8 S -","- C176 H224 O64 S8 -","8","2","","de Castro, Marcos V.; Ióca, Laura P; Williams, David E.; Costa, Bruna Z.; Mizuno, Carolina M.; Santos, Mario F. C.; de Jesus, Karen; Ferreira, Éverton L F; Seleghim, Mirna H. R.; Sette, Lara D.; Pereira Filho, Edenir R.; Ferreira, Antonio G.; Gonçalves, Natália S; Santos, Raquel A.; Patrick, Brian O.; Andersen, Raymond J.; Berlinck, Roberto G. S.","Condensation of Macrocyclic Polyketides Produced by Penicillium sp. DRF2 with Mercaptopyruvate Represents a New Fungal Detoxification Pathway.","Journal of natural products","2016","79","6","1668","1678","10.1021/acs.jnatprod.6b00295","","x-ray","0.71073","MoKα","","0.1165","0.1115","","","0.3003","0.3038","","","","","","1.071","","","","has coordinates","184149","2020-10-21","18:00:00",""
"1543602","10.7952","0.0007","17.2819","0.0011","23.5916","0.0013","90","","90","","90","","4401.3","0.5","100","2","100","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C19.5 H28.98 O10.99 S -","- C19.5 H28.9833 O10.9916 S -","- C156 H231.866 O87.9332 S8 -","8","2","","de Castro, Marcos V.; Ióca, Laura P; Williams, David E.; Costa, Bruna Z.; Mizuno, Carolina M.; Santos, Mario F. C.; de Jesus, Karen; Ferreira, Éverton L F; Seleghim, Mirna H. R.; Sette, Lara D.; Pereira Filho, Edenir R.; Ferreira, Antonio G.; Gonçalves, Natália S; Santos, Raquel A.; Patrick, Brian O.; Andersen, Raymond J.; Berlinck, Roberto G. S.","Condensation of Macrocyclic Polyketides Produced by Penicillium sp. DRF2 with Mercaptopyruvate Represents a New Fungal Detoxification Pathway.","Journal of natural products","2016","79","6","1668","1678","10.1021/acs.jnatprod.6b00295","","x-ray","0.71073","MoKα","","0.0564","0.0414","","","0.0944","0.1055","","","","","","1.02","","","","has coordinates,has disorder","217633","2020-10-21","18:00:00",""
"1543640","10.1553","0.0017","10.4128","0.0017","12.5099","0.0019","80.379","0.01","69.257","0.007","70.505","0.007","1164.4","0.3","293","2","293","2","","","","","","","","3","P -1","-P 1","2","","","","- C25 H32 O7 -","- C25 H32 O7 -","- C50 H64 O14 -","2","1","","Zhang, Lai-Bin; Lv, Jie-Li; Liu, Jun-Wei","Phthalide Derivatives with Anticoagulation Activities from Angelica sinensis.","Journal of natural products","2016","79","7","1857","1861","10.1021/acs.jnatprod.6b00080","","","1.54178","CuKα","","0.0502","0.047","","","0.1364","0.1445","","","","","","1.06","","","","has coordinates","184934","2020-10-21","18:00:00",""
"1543641","12.9007","0.0004","22.9463","0.0007","11.5098","0.0003","90","","114.234","0.001","90","","3106.92","0.16","296","2","296.15","","","","","","","","","3","P 1 21/c 1","-P 2ybc","14","","","","- C36 H42 O6 -","- C36 H42 O6 -","- C144 H168 O24 -","4","1","","Zhang, Lai-Bin; Lv, Jie-Li; Liu, Jun-Wei","Phthalide Derivatives with Anticoagulation Activities from Angelica sinensis.","Journal of natural products","2016","79","7","1857","1861","10.1021/acs.jnatprod.6b00080","","","1.54178","CuKα","","0.0484","0.0423","","","0.1173","0.1226","","","","","","1.04","","","","has coordinates","184934","2020-10-21","18:00:00",""
"1543725","13.2223","0.0003","19.43","0.0004","13.7491","0.0003","90","","103.14","0.001","90","","3439.79","0.13","130","","130","","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C33 H44 O9 -","- C33 H44 O9 -","- C132 H176 O36 -","4","2","","Zhou, Bin; Wu, Yan; Dalal, Seema; Cassera, Maria B.; Yue, Jian-Min","Euphorbesulins A-P, Structurally Diverse Diterpenoids from Euphorbia esula.","Journal of natural products","2016","79","8","1952","1961","10.1021/acs.jnatprod.6b00205","","","1.54178","CuKα","","0.0772","0.0747","","","0.1902","0.1939","","","","","","1.031","","","","has coordinates","186253","2020-10-21","18:00:00",""
"1543773","11.0841","0.0002","20.46","0.0004","12.6447","0.0002","90","","90","","90","","2867.57","0.09","293","2","293","2","","","","","","","","3","C 2 2 21","C 2c 2","20","","","","- C15 H19 O5.5 -","- C15 H19 O5.5 -","- C120 H152 O44 -","8","1","","Zhou, Xue-Ming; Zheng, Cai-Juan; Gan, Li-She; Chen, Guang-Ying; Zhang, Xiao-Peng; Song, Xiao-Ping; Li, Gao-Nan; Sun, Chong-Ge","Bioactive Phenanthrene and Bibenzyl Derivatives from the Stems of Dendrobium nobile.","Journal of natural products","2016","79","7","1791","1797","10.1021/acs.jnatprod.6b00252","","","1.54184","CuKα","","0.0345","0.0336","","","0.0918","0.0926","","","","","","1.021","","","","has coordinates","194547","2020-10-21","18:00:00",""
"1543978","8.2824","0.0002","11.9132","0.0003","18.2409","0.0005","90","","90","","90","","1799.83","0.08","293","2","293","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C21 H15 Cl O8 -","- C21 H15 Cl O8 -","- C84 H60 Cl4 O32 -","4","1","","Chen, Senhua; Chen, Dongni; Cai, Runlin; Cui, Hui; Long, Yuhua; Lu, Yongjun; Li, Chunyuan; She, Zhigang","Cytotoxic and Antibacterial Preussomerins from the Mangrove Endophytic Fungus Lasiodiplodia theobromae ZJ-HQ1.","Journal of natural products","2016","79","9","2397","2402","10.1021/acs.jnatprod.6b00639","","","1.54178","CuKα","","0.0393","0.035","","","0.085","0.0896","","","","","","1.056","","","","has coordinates","186957","2020-10-21","18:00:00",""
"1544014","8.9399","0.0002","12.3247","0.0002","15.5926","0.0003","90","","90","","90","","1718.02","0.06","100","2","100","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C20 H26 N2 O2 -","- C20 H26 N2 O2 -","- C80 H104 N8 O8 -","4","1","","Cheng, Gui-Guang; Li, Dan; Hou, Bo; Li, Xiao-Nian; Liu, Lu; Chen, Ying-Ying; Lunga, Paul-Keilah; Khan, Afsar; Liu, Ya-Ping; Zuo, Zhi-Li; Luo, Xiao-Dong","Melokhanines A-J, Bioactive Monoterpenoid Indole Alkaloids with Diverse Skeletons from Melodinus khasianus.","Journal of natural products","2016","79","9","2158","2166","10.1021/acs.jnatprod.6b00011","","","1.54178","CuKα","","0.0274","0.0274","","","0.0697","0.0698","","","","","","1.076","","","","has coordinates","186956","2020-10-21","18:00:00",""
"1544246","8.9728","0.0004","13.5806","0.0006","16.6376","0.0007","93.952","0.002","103.777","0.002","90.502","0.002","1963.72","0.15","100","","296.15","","","","","","","","","3","P -1","-P 1","2","","","","- C21.5 H26 O6.5 -","- C21.5 H25.5 O6.5 -","- C86 H102 O26 -","4","2","","He, Ruijie; Huang, Xishan; Zhang, Yanjun; Wu, Liangdeng; Nie, Hui; Zhou, Dexiong; Liu, Buming; Deng, Shengping; Yang, Ruiyun; Huang, Shuai; Nong, Zhijie; Li, Jun; Huang, Yan","Structural Characterization and Assessment of the Cytotoxicity of 2,3-Dihydro-1H-indene Derivatives and Coumarin Glucosides from the Bark of Streblus indicus.","Journal of natural products","2016","79","10","2472","2478","10.1021/acs.jnatprod.6b00306","","","1.54184","CuKα","","0.0511","0.0478","","","0.1356","0.139","","","","","","1.047","","","","has coordinates","214153","2020-10-21","18:00:00",""
"1544317","8.4155","0.0005","10.1342","0.0006","25.9099","0.0015","90","","90","","90","","2209.7","0.2","100.2","0.8","100.2","0.8","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","vernavosine methyl iodide","","","- C22 H29 I N2 O5 -","- C22 H29 I N2 O5 -","- C88 H116 I4 N8 O20 -","4","1","","Nge, Choy-Eng; Sim, Kae-Shin; Lim, Siew-Huah; Thomas, Noel F.; Low, Yun-Yee; Kam, Toh-Seok","A Hexacyclic, Iboga-Derived Monoterpenoid Indole with a Contracted Tetrahydroazepine C-Ring and Incorporation of an Isoxazolidine Moiety, a Seco-Corynanthean, an Aspidosperma-Aspidosperma Bisindole with Anticancer Properties, and the Absolute Configuration of the Pyridopyrimidine Indole Alkaloid, Vernavosine.","Journal of natural products","2016","79","10","2709","2717","10.1021/acs.jnatprod.6b00674","","","0.71073","MoKα","","0.0434","0.0381","","","0.0835","0.0861","","","","","","1.061","","","","has coordinates","187935","2020-10-21","18:00:00",""
"1544318","7.6879","0.0008","13.0251","0.0014","18.905","0.002","90","","90","","90","","1893.1","0.3","100","2","100","2","","","","","","","","5","P 21 21 21","P 2ac 2ab","19","Cononuridine methyl iodide","","","- C20 H23 I N2 O2 -","- C20 H23 I N2 O2 -","- C80 H92 I4 N8 O8 -","4","1","","Nge, Choy-Eng; Sim, Kae-Shin; Lim, Siew-Huah; Thomas, Noel F.; Low, Yun-Yee; Kam, Toh-Seok","A Hexacyclic, Iboga-Derived Monoterpenoid Indole with a Contracted Tetrahydroazepine C-Ring and Incorporation of an Isoxazolidine Moiety, a Seco-Corynanthean, an Aspidosperma-Aspidosperma Bisindole with Anticancer Properties, and the Absolute Configuration of the Pyridopyrimidine Indole Alkaloid, Vernavosine.","Journal of natural products","2016","79","10","2709","2717","10.1021/acs.jnatprod.6b00674","","","0.71073","MoKα","","0.0606","0.0439","","","0.0974","0.1027","","","","","","0.938","","","","has coordinates","187935","2020-10-21","18:00:00",""
"1544484","16.2628","0.0003","16.2628","0.0003","35.9975","0.001","90","","90","","90","","9520.6","0.4","293","2","293","2","","","","","","","","4","P 43 21 2","P 4nw 2abw","96","Conofolidine","","","- C45 H54 N4 O11 -","- C45 H54 N4 O11 -","- C360 H432 N32 O88 -","8","1","","Nge, Choy-Eng; Sim, Kae-Shin; Lim, Siew-Huah; Thomas, Noel F.; Low, Yun-Yee; Kam, Toh-Seok","A Hexacyclic, Iboga-Derived Monoterpenoid Indole with a Contracted Tetrahydroazepine C-Ring and Incorporation of an Isoxazolidine Moiety, a Seco-Corynanthean, an Aspidosperma-Aspidosperma Bisindole with Anticancer Properties, and the Absolute Configuration of the Pyridopyrimidine Indole Alkaloid, Vernavosine.","Journal of natural products","2016","79","10","2709","2717","10.1021/acs.jnatprod.6b00674","","","1.54184","CuKα","","0.0934","0.0808","","","0.2285","0.2397","","","","","","1.416","","","","has coordinates","187846","2020-10-21","18:00:00",""
"1544485","9.1262","0.0004","11.2141","0.0005","13.5183","0.0006","90","","99.968","0.003","90","","1362.61","0.11","296","2","296.15","","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C25 H38 O10 -","- C25 H38 O10 -","- C50 H76 O20 -","2","1","","Liu, Qing-Xin; Yang, Yong-Xun; Zhang, Jian-Ping; Chen, Li-Ping; Shen, Yun-Heng; Li, Hui-Liang; Zhang, Wei-Dong","Isolation, Structure Elucidation, and Absolute Configuration of Highly Oxygenated Germacranolides from Carpesium cernuum.","Journal of natural products","2016","79","10","2479","2486","10.1021/acs.jnatprod.6b00315","","","1.54178","CuKα","","0.0533","0.0514","","","0.1426","0.1461","","","","","","1.027","","","","has coordinates","187847","2020-10-21","18:00:00",""
"1544486","9.8736","0.0003","18.0856","0.0006","27.7795","0.0009","90","","90","","90","","4960.6","0.3","296","2","296.15","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C24 H34 O9 -","- C24 H34 O9 -","- C192 H272 O72 -","8","2","","Liu, Qing-Xin; Yang, Yong-Xun; Zhang, Jian-Ping; Chen, Li-Ping; Shen, Yun-Heng; Li, Hui-Liang; Zhang, Wei-Dong","Isolation, Structure Elucidation, and Absolute Configuration of Highly Oxygenated Germacranolides from Carpesium cernuum.","Journal of natural products","2016","79","10","2479","2486","10.1021/acs.jnatprod.6b00315","","","1.54178","CuKα","","0.1267","0.0721","","","0.1846","0.219","","","","","","1.009","","","","has coordinates","187848","2020-10-21","18:00:00",""
"1544487","10.3232","0.0002","11.0194","0.0002","19.2565","0.0003","90","","90","","90","","2190.53","0.07","130","","130","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C20 H32 O10 -","- C20 H32 O10 -","- C80 H128 O40 -","4","1","","Liu, Qing-Xin; Yang, Yong-Xun; Zhang, Jian-Ping; Chen, Li-Ping; Shen, Yun-Heng; Li, Hui-Liang; Zhang, Wei-Dong","Isolation, Structure Elucidation, and Absolute Configuration of Highly Oxygenated Germacranolides from Carpesium cernuum.","Journal of natural products","2016","79","10","2479","2486","10.1021/acs.jnatprod.6b00315","","","1.54178","CuKα","","0.0337","0.0329","","","0.0855","0.0861","","","","","","1.085","","","","has coordinates,has disorder","187849","2020-10-21","18:00:00",""
"1544488","18.458","0.0002","18.458","0.0002","28.8647","0.0004","90","","90","","120","","8516.61","0.18","130","","130","","","","","","","","","3","P 32 2 1","P 32 2""","154","","","","- C25 H36 O9 -","- C25 H36 O9 -","- C300 H432 O108 -","12","2","","Liu, Qing-Xin; Yang, Yong-Xun; Zhang, Jian-Ping; Chen, Li-Ping; Shen, Yun-Heng; Li, Hui-Liang; Zhang, Wei-Dong","Isolation, Structure Elucidation, and Absolute Configuration of Highly Oxygenated Germacranolides from Carpesium cernuum.","Journal of natural products","2016","79","10","2479","2486","10.1021/acs.jnatprod.6b00315","","","1.54178","CuKα","","0.0598","0.0512","","","0.1372","0.1445","","","","","","0.999","","","","has coordinates","187850","2020-10-21","18:00:00",""
"1544489","10.2307","0.0001","10.2307","0.0001","20.5352","0.0003","90","","90","","90","","2149.36","0.04","130","","130","","","","","","","","","3","P 41","P 4w","76","","","","- C19 H32 O10 -","- C19 H32 O10 -","- C76 H128 O40 -","4","1","","Liu, Qing-Xin; Yang, Yong-Xun; Zhang, Jian-Ping; Chen, Li-Ping; Shen, Yun-Heng; Li, Hui-Liang; Zhang, Wei-Dong","Isolation, Structure Elucidation, and Absolute Configuration of Highly Oxygenated Germacranolides from Carpesium cernuum.","Journal of natural products","2016","79","10","2479","2486","10.1021/acs.jnatprod.6b00315","","","1.54178","CuKα","","0.0404","0.0393","","","0.1042","0.1054","","","","","","1.049","","","","has coordinates","187851","2020-10-21","18:00:00",""
"1544490","9.1352","0.0006","13.4879","0.001","20.6303","0.0014","90","","90","","90","","2542","0.3","130","","130","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C25 H34 O9 -","- C25 H34 O9 -","- C100 H136 O36 -","4","1","","Liu, Qing-Xin; Yang, Yong-Xun; Zhang, Jian-Ping; Chen, Li-Ping; Shen, Yun-Heng; Li, Hui-Liang; Zhang, Wei-Dong","Isolation, Structure Elucidation, and Absolute Configuration of Highly Oxygenated Germacranolides from Carpesium cernuum.","Journal of natural products","2016","79","10","2479","2486","10.1021/acs.jnatprod.6b00315","","","1.54178","CuKα","","0.067","0.0556","","","0.1431","0.1538","","","","","","1.039","","","","has coordinates","187852","2020-10-21","18:00:00",""
"1544491","18.4959","0.0002","18.4959","0.0002","28.8516","0.0005","90","","90","","120","","8547.7","0.2","130","","130","","","","","","","","","3","P 32 2 1","P 32 2""","154","","","","- C25 H36 O9 -","- C25 H36 O9 -","- C300 H432 O108 -","12","2","","Liu, Qing-Xin; Yang, Yong-Xun; Zhang, Jian-Ping; Chen, Li-Ping; Shen, Yun-Heng; Li, Hui-Liang; Zhang, Wei-Dong","Isolation, Structure Elucidation, and Absolute Configuration of Highly Oxygenated Germacranolides from Carpesium cernuum.","Journal of natural products","2016","79","10","2479","2486","10.1021/acs.jnatprod.6b00315","","","1.54178","CuKα","","0.0996","0.0875","","","0.2443","0.2594","","","","","","1.087","","","","has coordinates","187853","2020-10-21","18:00:00",""
"1544492","9.0537","0.0004","9.9085","0.0005","13.6295","0.0007","90","","93.611","0.002","90","","1220.26","0.1","130","","130","","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C25 H34 O9 -","- C25 H34 O9 -","- C50 H68 O18 -","2","1","","Liu, Qing-Xin; Yang, Yong-Xun; Zhang, Jian-Ping; Chen, Li-Ping; Shen, Yun-Heng; Li, Hui-Liang; Zhang, Wei-Dong","Isolation, Structure Elucidation, and Absolute Configuration of Highly Oxygenated Germacranolides from Carpesium cernuum.","Journal of natural products","2016","79","10","2479","2486","10.1021/acs.jnatprod.6b00315","","","1.54178","CuKα","","0.0331","0.0329","","","0.0854","0.0857","","","","","","1.058","","","","has coordinates","187854","2020-10-21","18:00:00",""
"1544493","22.8955","0.0003","22.8955","0.0003","9.7127","0.0002","90","","90","","120","","4409.31","0.12","130","2","130","","","","","","","","","3","P 61","P 61","169","","","","- C26 H40 O10 -","- C26 H40 O10 -","- C156 H240 O60 -","6","1","","Liu, Qing-Xin; Yang, Yong-Xun; Zhang, Jian-Ping; Chen, Li-Ping; Shen, Yun-Heng; Li, Hui-Liang; Zhang, Wei-Dong","Isolation, Structure Elucidation, and Absolute Configuration of Highly Oxygenated Germacranolides from Carpesium cernuum.","Journal of natural products","2016","79","10","2479","2486","10.1021/acs.jnatprod.6b00315","","","1.54178","CuKα","","0.0573","0.0524","","","0.1456","0.1509","","","","","","1.051","","","","has coordinates","187855","2020-10-21","18:00:00",""
"1544494","5.7156","0.0001","18.5622","0.0002","23.127","0.0003","90","","90","","90","","2453.64","0.06","296","2","296.15","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C23 H34 O8 -","- C23 H34 O8 -","- C92 H136 O32 -","4","1","","Liu, Qing-Xin; Yang, Yong-Xun; Zhang, Jian-Ping; Chen, Li-Ping; Shen, Yun-Heng; Li, Hui-Liang; Zhang, Wei-Dong","Isolation, Structure Elucidation, and Absolute Configuration of Highly Oxygenated Germacranolides from Carpesium cernuum.","Journal of natural products","2016","79","10","2479","2486","10.1021/acs.jnatprod.6b00315","","","1.54178","CuKα","","0.0438","0.041","","","0.1091","0.1125","","","","","","1.035","","","","has coordinates","187856","2020-10-21","18:00:00",""
"1544722","11.1727","0.0002","25.9159","0.0005","12.5581","0.0008","90","","91.097","0.006","90","","3635.5","0.3","193","2","193","2","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C37 H48 O12 -","- C37 H48 O12 -","- C148 H192 O48 -","4","2","","Esposito, Mélissa; Nothias, Louis-Félix; Nedev, Hirsto; Gallard, Jean-François; Leyssen, Pieter; Retailleau, Pascal; Costa, Jean; Roussi, Fanny; Iorga, Bogdan I.; Paolini, Julien; Litaudon, Marc","Euphorbia dendroides Latex as a Source of Jatrophane Esters: Isolation, Structural Analysis, Conformational Study, and Anti-CHIKV Activity.","Journal of natural products","2016","79","11","2873","","10.1021/acs.jnatprod.6b00644","","","1.54187","CuKα","","0.0522","0.0399","","","0.0922","0.1101","","","","","","1.106","","","","has coordinates","188878","2020-10-21","18:00:00",""
"1544723","41.529","0.0014","8.6149","0.0003","11.037","0.007","90","","100.788","0.007","90","","3879","2","193","2","193","2","","","","","","","","3","C 1 2 1","C 2y","5","","","","- C39 H46.5 O12.25 -","- C38 H44 O12 -","- C152 H176 O48 -","4","1","","Esposito, Mélissa; Nothias, Louis-Félix; Nedev, Hirsto; Gallard, Jean-François; Leyssen, Pieter; Retailleau, Pascal; Costa, Jean; Roussi, Fanny; Iorga, Bogdan I.; Paolini, Julien; Litaudon, Marc","Euphorbia dendroides Latex as a Source of Jatrophane Esters: Isolation, Structural Analysis, Conformational Study, and Anti-CHIKV Activity.","Journal of natural products","2016","79","11","2873","","10.1021/acs.jnatprod.6b00644","","","1.54187","CuKα","","0.0823","0.0483","","","0.1169","0.1512","","","","","","1.022","","","","has coordinates","188878","2020-10-21","18:00:00",""
"1544724","18.3977","0.0012","16.9305","0.0005","12.7043","0.0004","90","","90","","90","","3957.2","0.3","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C36 H50 O16 -","- C36 H50 O16 -","- C144 H200 O64 -","4","1","","Esposito, Mélissa; Nothias, Louis-Félix; Nedev, Hirsto; Gallard, Jean-François; Leyssen, Pieter; Retailleau, Pascal; Costa, Jean; Roussi, Fanny; Iorga, Bogdan I.; Paolini, Julien; Litaudon, Marc","Euphorbia dendroides Latex as a Source of Jatrophane Esters: Isolation, Structural Analysis, Conformational Study, and Anti-CHIKV Activity.","Journal of natural products","2016","79","11","2873","","10.1021/acs.jnatprod.6b00644","","","1.54187","CuKα","","0.068","0.053","","","0.137","0.1607","","","","","","1.035","","","","has coordinates","188878","2020-10-21","18:00:00",""
"1545001","8.407","0.0004","23.1784","0.0013","11.0659","0.0006","90","","100.323","0.002","90","","2121.41","0.19","100","2","100","2","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C23 H30 O6 -","- C23 H30 O6 -","- C92 H120 O24 -","4","2","","Qiao, Yuben; Xu, Qianqian; Hu, Zhengxi; Li, Xiao-Nian; Xiang, Ming; Liu, Junjun; Huang, Jinfeng; Zhu, Hucheng; Wang, Jianping; Luo, Zengwei; Xue, Yongbo; Zhang, Yonghui","Diterpenoids of the Cassane Type from Caesalpinia decapetala.","Journal of natural products","2016","79","12","3134","3142","10.1021/acs.jnatprod.6b00910","","","1.54178","CuKα","","0.0553","0.0545","","","0.1412","0.1422","","","","","","1.075","","","","has coordinates","189878","2020-10-21","18:00:00",""
"1545002","9.4232","0.0002","8.8867","0.0002","18.0421","0.0004","90","","104.356","0.001","90","","1463.69","0.06","296","2","296","2","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C30 H38 O11 -","- C30 H38 O11 -","- C60 H76 O22 -","2","1","","Gao, Lei; Zhang, Rujun; Lan, Jianfeng; Ning, Ruonan; Wu, Di; Chen, Di; Zhao, Weimin","β-Dihydroagarofuran-Type Sesquiterpenes from the Seeds of Celastrus monospermus and Their Lifespan-Extending Effects on the Nematode Caenorhabditis elegans.","Journal of natural products","2016","79","12","3039","3046","10.1021/acs.jnatprod.6b00648","","","1.54178","CuKα","","0.0322","0.0304","","","0.0807","0.0872","","","","","","1.094","","","","has coordinates","189879","2020-10-21","18:00:00",""
"1553288","5.8324","0.0007","12.9306","0.0014","17.55","0.002","90","","90","","90","","1323.6","0.3","90","","90","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C15 H22 O2 -","- C15 H22 O2 -","- C60 H88 O8 -","4","1","","Matsuo, Yukiko; Maeda, Saori; Ohba, Chika; Fukaya, Haruhiko; Mimaki, Yoshihiro","Vetiverianines A, B, and C: Sesquiterpenoids from Vetiveria zizanioides Roots.","Journal of natural products","2016","79","9","2175","2180","10.1021/acs.jnatprod.6b00140","","","0.71073","MoKα","","0.0325","0.0304","","","0.0763","0.0775","","","","","","1.04","","","","has coordinates","234058","2020-10-21","18:00:00",""
"1553289","6.242","0.0006","16.329","0.0015","28.076","0.003","90","","90","","90","","2861.7","0.5","90","","90","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C15 H27 O2.5 -","- C15 H27 O2.5 -","- C120 H216 O20 -","8","2","","Matsuo, Yukiko; Maeda, Saori; Ohba, Chika; Fukaya, Haruhiko; Mimaki, Yoshihiro","Vetiverianines A, B, and C: Sesquiterpenoids from Vetiveria zizanioides Roots.","Journal of natural products","2016","79","9","2175","2180","10.1021/acs.jnatprod.6b00140","","","0.71073","MoKα","","0.0425","0.0376","","","0.0825","0.0851","","","","","","1.05","","","","has coordinates","275856","2022-06-07","07:08:27",""
"1553290","5.6076","0.0005","7.3152","0.0006","32.2","0.003","90","","90","","90","","1320.9","0.2","90","","90","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C15 H24 O2 -","- C15 H24 O2 -","- C60 H96 O8 -","4","1","","Matsuo, Yukiko; Maeda, Saori; Ohba, Chika; Fukaya, Haruhiko; Mimaki, Yoshihiro","Vetiverianines A, B, and C: Sesquiterpenoids from Vetiveria zizanioides Roots.","Journal of natural products","2016","79","9","2175","2180","10.1021/acs.jnatprod.6b00140","","","0.71073","MoKα","","0.0338","0.0331","","","0.086","0.0868","","","","","","1.057","","","","has coordinates,has disorder","234060","2020-10-21","18:00:00",""
"1553291","9.1399","0.0002","11.2214","0.0003","19.328","0.0005","90","","90","","90","","1982.33","0.09","123","0.1","123","0.1","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C23 H26 O7 -","- C23 H26 O7 -","- C92 H104 O28 -","4","1","","Abdissa, Negera; Pan, Fangfang; Gruhonjic, Amra; Gräfenstein, Jürgen; Fitzpatrick, Paul A.; Landberg, Göran; Rissanen, Kari; Yenesew, Abiy; Erdélyi, Máté","Naphthalene Derivatives from the Roots of Pentas parvifolia and Pentas bussei.","Journal of natural products","2016","79","9","2181","2187","10.1021/acs.jnatprod.6b00178","","x-ray","1.54184","CuKα","","0.0532","0.0494","","","0.1382","0.142","","","","","","1.022","","","","has coordinates","234061","2020-10-21","18:00:00",""
"1553292","5.20049","0.00004","18.36541","0.0001","22.63281","0.00012","90","","90","","90","","2161.64","0.02","123.01","0.1","123.01","0.1","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C24 H28 O7 -","- C24 H28 O7 -","- C96 H112 O28 -","4","1","","Abdissa, Negera; Pan, Fangfang; Gruhonjic, Amra; Gräfenstein, Jürgen; Fitzpatrick, Paul A.; Landberg, Göran; Rissanen, Kari; Yenesew, Abiy; Erdélyi, Máté","Naphthalene Derivatives from the Roots of Pentas parvifolia and Pentas bussei.","Journal of natural products","2016","79","9","2181","2187","10.1021/acs.jnatprod.6b00178","","x-ray","1.54184","CuKα","","0.0387","0.0381","","","0.1001","0.1009","","","","","","1.025","","","","has coordinates","234062","2020-10-21","18:00:00",""
"1553293","6.5201","0.0001","7.2318","0.0001","24.7168","0.0004","90","","90","","90","","1165.45","0.03","290","2","290","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C13 H12 N2 O3 -","- C13 H12 N2 O3 -","- C52 H48 N8 O12 -","4","1","","Zhou, Haibo; Li, Liyuan; Wu, Chongming; Kurtán, Tibor; Mándi, Attila; Liu, Yankai; Gu, Qianqun; Zhu, Tianjiao; Guo, Peng; Li, Dehai","Penipyridones A-F, Pyridone Alkaloids from Penicillium funiculosum.","Journal of natural products","2016","79","7","1783","1790","10.1021/acs.jnatprod.6b00218","","","1.54184","CuKα","","0.03","0.0298","","","0.0817","0.0818","","","","","","1.039","","","","has coordinates","234063","2020-10-21","18:00:00",""
"1553294","6.3429","0.0001","7.2295","0.0001","22.835","0.0004","86.897","0.001","87.866","0.001","68.166","0.001","970.42","0.03","170","2","170","2","","","","","","","","4","P 1","P 1","1","celastrusin A","29-O-caffeoyl-friedelin","","- C45 H63 N O7 -","- C45 H63 N O7 -","- C45 H63 N O7 -","1","1","","Li, Jin-Long; Wu, Lei; Wu, Jian; Feng, Hong-Xuan; Wang, Hong-Min; Fu, Yan; Zhang, Ru-Jun; Zhang, Hai-Yan; Zhao, Wei-Min","Caffeoyl Triterpenoid Esters as Potential Anti-ischemic Stroke Agents from Celastrus orbiculatus.","Journal of natural products","2016","79","11","2774","2779","10.1021/acs.jnatprod.6b00314","","","1.54178","CuKα","","0.0405","0.0379","","","0.1002","0.1024","","","","","","1.065","","","","has coordinates","234065","2020-10-21","18:00:00",""
"1553295","7.33508","0.00019","7.7336","0.0002","16.8499","0.0004","90","","90","","90","","955.84","0.04","100.3","","100.3","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C10 H13 N O4 -","- C10 H13 N O4 -","- C40 H52 N4 O16 -","4","1","","Zeng, Yao-Bo; Liu, Xiao-Ling; Zhang, Yi; Li, Chuang-Jun; Zhang, Dong-Ming; Peng, Yao-Zong; Zhou, Xing; Du, Hong-Fei; Tan, Chun-Bing; Zhang, Yu-Yu; Yang, Da-Jian","Cantharimide and Its Derivatives from the Blister Beetle Mylabris phalerata Palla.","Journal of natural products","2016","79","8","2032","2038","10.1021/acs.jnatprod.6b00332","","","1.54184","CuKα","","0.0321","0.0318","","","0.0856","0.0857","","","","","","1.079","","","","has coordinates","234066","2020-10-21","18:00:00",""
"1553296","5.376","0.0005","11.9366","0.0011","13.1122","0.0013","90","","90","","90","","841.43","0.14","104.3","","104.3","","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C9 H11 N O3 -","- C9 H11 N O3 -","- C36 H44 N4 O12 -","4","1","","Zeng, Yao-Bo; Liu, Xiao-Ling; Zhang, Yi; Li, Chuang-Jun; Zhang, Dong-Ming; Peng, Yao-Zong; Zhou, Xing; Du, Hong-Fei; Tan, Chun-Bing; Zhang, Yu-Yu; Yang, Da-Jian","Cantharimide and Its Derivatives from the Blister Beetle Mylabris phalerata Palla.","Journal of natural products","2016","79","8","2032","2038","10.1021/acs.jnatprod.6b00332","","","1.5418","CuKα","","0.0373","0.0364","","","0.0929","0.0945","","","","","","1.072","","","","has coordinates","234068","2020-10-21","18:00:00",""
"1553297","8.2263","0.0002","19.2406","0.0005","16.9322","0.0005","90","","93.261","0.002","90","","2675.67","0.12","173","","173","","","","","","","","","4","P 1 21/c 1","-P 2ybc","14","PC-3","","","- C37 H26 N2 O7 -","- C37 H26 N2 O7 -","- C148 H104 N8 O28 -","4","1","","Shono, Takumi; Ishikawa, Naoki; Toume, Kazufumi; Arai, Midori A.; Masu, Hyuma; Koyano, Takashi; Kowithayakorn, Thaworn; Ishibashi, Masami","Cerasoidine, a Bis-aporphine Alkaloid Isolated from Polyalthia cerasoides during Screening for Wnt Signal Inhibitors.","Journal of natural products","2016","79","8","2083","2088","10.1021/acs.jnatprod.6b00409","","","1.54178","CuKα","","0.0784","0.0525","","","0.1363","0.1526","","","","","","1.034","","","","has coordinates","234069","2020-10-21","18:00:00",""
"1553298","7.3316","0.0005","9.7804","0.0006","17.8769","0.0012","90","","90","","90","","1281.88","0.15","100","2","100","2","","","","","","","","4","P 21 21 21","P 2ac 2ab","19","","","","- C14 H19 Br O2 -","- C14 H19 Br O2 -","- C56 H76 Br4 O8 -","4","1","","Chen, Jia-Yu; Huang, Chiung-Yao; Lin, Yun-Sheng; Hwang, Tsong-Long; Wang, Wei-Lung; Chiou, Shu-Fen; Sheu, Jyh-Horng","Halogenated Sesquiterpenoids from the Red Alga Laurencia tristicha Collected in Taiwan.","Journal of natural products","2016","79","9","2315","2323","10.1021/acs.jnatprod.6b00452","","","1.54178","CuKα","","0.0186","0.0186","","","0.0488","0.0488","","","","","","1.181","","","","has coordinates","234070","2020-10-21","18:00:00",""
"1553299","6.3082","0.0004","7.5108","0.0005","8.11","0.0005","88.911","0.004","85.044","0.004","77.888","0.005","374.29","0.04","120","2","120","2","","","","","","","","3","P 1","P 1","1","Pestalotioprolide B hydrate","","","- C14 H22 O6 -","- C14 H22 O6 -","- C14 H22 O6 -","1","1","","Liu, Shuai; Dai, Haofu; Makhloufi, Gamall; Heering, Christian; Janiak, Christoph; Hartmann, Rudolf; Mándi, Attila; Kurtán, Tibor; Müller, Werner E G; Kassack, Matthias U.; Lin, Wenhan; Liu, Zhen; Proksch, Peter","Cytotoxic 14-Membered Macrolides from a Mangrove-Derived Endophytic Fungus, Pestalotiopsis microspora.","Journal of natural products","2016","79","9","2332","2340","10.1021/acs.jnatprod.6b00473","","","1.54178","CuKα","","0.0349","0.0342","","","0.0869","0.0878","","","","","","1.026","","","","has coordinates","234071","2020-10-21","18:00:00",""
"1553300","36.533","0.004","4.9693","0.0006","7.6479","0.0009","90","","90","","90","","1388.4","0.3","100","2","100","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","Pestalotioprolide C","","","- C14 H24 O4 -","- C14 H24 O4 -","- C56 H96 O16 -","4","1","","Liu, Shuai; Dai, Haofu; Makhloufi, Gamall; Heering, Christian; Janiak, Christoph; Hartmann, Rudolf; Mándi, Attila; Kurtán, Tibor; Müller, Werner E G; Kassack, Matthias U.; Lin, Wenhan; Liu, Zhen; Proksch, Peter","Cytotoxic 14-Membered Macrolides from a Mangrove-Derived Endophytic Fungus, Pestalotiopsis microspora.","Journal of natural products","2016","79","9","2332","2340","10.1021/acs.jnatprod.6b00473","","","1.54178","CuKα","","0.0931","0.0867","","","0.2354","0.2408","","","","","","1.161","","","","has coordinates","234074","2020-10-21","18:00:00",""
"1553301","4.8042","0.0003","7.6036","0.0004","37.247","0.002","90","","90","","90","","1360.6","0.13","150","2","150","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","nigrosporolide","","","- C14 H20 O4 -","- C14 H20 O4 -","- C56 H80 O16 -","4","1","","Liu, Shuai; Dai, Haofu; Makhloufi, Gamall; Heering, Christian; Janiak, Christoph; Hartmann, Rudolf; Mándi, Attila; Kurtán, Tibor; Müller, Werner E G; Kassack, Matthias U.; Lin, Wenhan; Liu, Zhen; Proksch, Peter","Cytotoxic 14-Membered Macrolides from a Mangrove-Derived Endophytic Fungus, Pestalotiopsis microspora.","Journal of natural products","2016","79","9","2332","2340","10.1021/acs.jnatprod.6b00473","","","0.71073","MoKα","","0.0331","0.0316","","","0.0787","0.0797","","","","","","1.088","","","","has coordinates","234075","2020-10-21","18:00:00",""
"1553302","10.0971","0.00018","6.95501","0.00013","18.0231","0.0003","90","","100.84","0.0007","90","","1243.1","0.04","90","","90","","","","","","","","","3","P 1 21 1","P 2yb","4","","","","- C26 H40 O7 -","- C26 H40 O7 -","- C52 H80 O14 -","2","1","","Kim, Jong Won; Ko, Sung-Kyun; Kim, Hye-Min; Kim, Gun-Hee; Son, Sangkeun; Kim, Gil Soo; Hwang, Gwi Ja; Jeon, Eun Soo; Shin, Kee-Sun; Ryoo, In-Ja; Hong, Young-Soo; Oh, Hyuncheol; Lee, Kyung Ho; Soung, Nak-Kyun; Hashizume, Daisuke; Nogawa, Toshihiko; Takahashi, Shunji; Kim, Bo Yeon; Osada, Hiroyuki; Jang, Jae-Hyuk; Ahn, Jong Seog","Stachybotrysin, an Osteoclast Differentiation Inhibitor from the Marine-Derived Fungus Stachybotrys sp. KCB13F013.","Journal of natural products","2016","79","10","2703","2708","10.1021/acs.jnatprod.6b00641","","","1.54184","CuKα","","0.0435","0.0343","","","0.0744","0.0843","","","","","","1.146","","","","has coordinates","234077","2020-10-21","18:00:00",""
"1553303","6.5355","0.0013","12.797","0.003","24.34","0.005","90","","90","","90","","2035.7","0.8","293","2","293","2","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C22 H30 O5 -","- C22 H30 O5 -","- C88 H120 O20 -","4","1","","Xu, Jing; Wang, Meicheng; Sun, Xiaocong; Ren, Quanhui; Cao, Xiangrong; Li, Shen; Su, Guochen; Tuerhong, Muhetaer; Lee, Dongho; Ohizumi, Yasushi; Bartlam, Mark; Guo, Yuanqiang","Bioactive Terpenoids from Salvia plebeia: Structures, NO Inhibitory Activities, and Interactions with iNOS.","Journal of natural products","2016","79","11","2924","2932","10.1021/acs.jnatprod.6b00733","","","0.71073","MoKα","","0.1233","0.0723","","","0.1455","0.1659","","","","","","1.015","","","","has coordinates","234078","2020-10-21","18:00:00",""
"1553304","6.37","0.0003","12.1724","0.0006","34.2046","0.0015","90","","90","","90","","2652.2","0.2","100","","100","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C30 H42 O5 -","- C30 H42 O5 -","- C120 H168 O20 -","4","1","","Olivier, Wesley J.; Kilah, Nathan L.; Horne, James; Bissember, Alex C.; Smith, Jason A.","ent-Labdane Diterpenoids from Dodonaea viscosa.","Journal of natural products","2016","79","12","3117","3126","10.1021/acs.jnatprod.6b00858","","x-ray","1.54178","CuKα","","0.0571","0.0508","","0.0841","0.0806","0.0841","","","","","","0.9989","","","","has coordinates","234080","2020-10-21","18:00:00",""
"1553305","7.9309","0.0011","10.716","0.0014","31.529","0.004","90","","90","","90","","2679.6","0.6","100","","100","","","","","","","","","3","P 21 21 21","P 2ac 2ab","19","","","","- C30 H42 O5 -","- C30 H42 O5 -","- C120 H168 O20 -","4","1","","Olivier, Wesley J.; Kilah, Nathan L.; Horne, James; Bissember, Alex C.; Smith, Jason A.","ent-Labdane Diterpenoids from Dodonaea viscosa.","Journal of natural products","2016","79","12","3117","3126","10.1021/acs.jnatprod.6b00858","","x-ray","1.54178","CuKα","","0.0424","0.0386","","0.0767","0.0731","0.0767","","","","","","0.984","","","","has coordinates","234080","2020-10-21","18:00:00",""
"1553306","29.0981","0.0016","8.0421","0.0005","11.3912","0.0006","90","","104.315","0.003","90","","2582.9","0.3","100","","100","","","","","","","","","4","C 1 2 1","C 2y","5","","","","- C28 H39 Cl O4 -","- C28 H39 Cl O4 -","- C112 H156 Cl4 O16 -","4","1","","Olivier, Wesley J.; Kilah, Nathan L.; Horne, James; Bissember, Alex C.; Smith, Jason A.","ent-Labdane Diterpenoids from Dodonaea viscosa.","Journal of natural products","2016","79","12","3117","3126","10.1021/acs.jnatprod.6b00858","","x-ray","1.54178","CuKα","","0.0476","0.0419","","0.1042","0.098","0.1042","","","","","","0.9871","","","","has coordinates","234080","2020-10-21","18:00:00",""