All Compounds in Database

Record Name Formula Exact Mass InChIKey Proton NMR Carbon NMR
20831 Withametelin P Withametelin P Withametelin P C34H50O12 650.330 InChIKey=MIHRHFBCKBVQMG-ANKSCFFMSA-N No Yes
20832 1,10-seco-Withametelin B 1,10-seco-Withametelin B 1,10-seco-Withametelin B C28H36O5 452.256 InChIKey=CNWDLTNXJPRUTP-JRQGXBBXSA-N No Yes
20833 12b-Hydroxy-1,10-seco-withametelin B 12b-Hydroxy-1,10-seco-withametelin B 12b-Hydroxy-1,10-seco-withametelin B C28H36O6 468.251 InChIKey=KPKHBVCOOBDWBC-CERXFINOSA-N No Yes
20834 Withangulatin B Withangulatin B Withangulatin B C28H38O9 518.252 InChIKey=SPWPBRRAOLCYQT-BXPAMZKMSA-N No Yes
20835 Withangulatin C Withangulatin C Withangulatin C C29H42O9 534.283 InChIKey=HHRFLEWOTNKYIA-PSVFIAKZSA-N No Yes
20836 Withangulatin D Withangulatin D Withangulatin D C29H44O10 552.293 InChIKey=GLIWPQHNZJTEGA-PROOTGEZSA-N No Yes
20837 Withangulatin E Withangulatin E Withangulatin E C29H42O8 518.288 InChIKey=RVCHUXQIKHDNFT-MTFPZNCHSA-N No Yes
20838 Withangulatin F Withangulatin F Withangulatin F C28H38O6 470.267 InChIKey=DGQQSGDPWKERCQ-QJFLRJBQSA-N No Yes
20839 Withangulatin G Withangulatin G Withangulatin G C28H40O10 536.262 InChIKey=AXVGKUKJECSDCD-AEJAVBLBSA-N No Yes
20840 Withangulatin H Withangulatin H Withangulatin H C29H42O9 534.283 InChIKey=NOHSWOPJQMNCOF-KTIQDBGTSA-N No Yes
20841 Jaborosalactone 43 Jaborosalactone 43 Jaborosalactone 43 C28H36O6 468.251 InChIKey=DVAOZDXOONOKIG-WJKLUFFNSA-N No Yes
20842 Jaborosalactone 44 Jaborosalactone 44 Jaborosalactone 44 C28H36O5 452.256 InChIKey=LODKXOXSZZXSNX-XUYMRLARSA-N No Yes
20843 Jaborosalactone 45 Jaborosalactone 45 Jaborosalactone 45 C27H34O7 470.230 InChIKey=GBALDQDQKBKJBM-HFTVBPQWSA-N No Yes
20844 12-O-Methyl-jaborosalactone 45 12-O-Methyl-jaborosalactone 45 12-O-Methyl-jaborosalactone 45 C28H36O7 484.246 InChIKey=AANVIZIEDAFIIC-KYDVVPGUSA-N No Yes
20845 Jaborosalactone 46 Jaborosalactone 46 Jaborosalactone 46 C29H40O9 532.267 InChIKey=BKBSWFJLJNUNEN-ZDKWHAKVSA-N No Yes
20846 Jaborosalactone 47 Jaborosalactone 47 Jaborosalactone 47 C29H42O10 550.278 InChIKey=ANDRRXONDSKBSB-AHZPIWKFSA-N No Yes
20847 Jaborosalactone 48 Jaborosalactone 48 Jaborosalactone 48 C28H36O8 500.241 InChIKey=ZBCKRYHWTDTAQB-GINIEFLTSA-N No Yes
20849 Physalin Y Physalin Y Physalin Y C28H32O10 528.200 InChIKey=AMFDIHDGEZLBRP-CFOVWGEISA-N No Yes
20850 Physalin Y Physalin Y Physalin Y C28H32O10 528.200 InChIKey=AMFDIHDGEZLBRP-CFOVWGEISA-N No Yes
20851 Physalin Z Physalin Z Physalin Z C28H30O10 526.184 InChIKey=JMNMXSXLYDOMTI-CFOVWGEISA-N No Yes
20852 Physalin Z Physalin Z Physalin Z C28H30O10 526.184 InChIKey=JMNMXSXLYDOMTI-CFOVWGEISA-N No Yes
20853 Isophysalin G Isophysalin G Isophysalin G C28H30O10 526.184 InChIKey=JMNMXSXLYDOMTI-LMODHVDTSA-N No Yes
20854 Isophysalin G Isophysalin G Isophysalin G C28H30O10 526.184 InChIKey=JMNMXSXLYDOMTI-LMODHVDTSA-N No Yes
20855 PhysalinW PhysalinW PhysalinW C28H30O10 526.184 InChIKey=YANMOPNMEHOFDO-XBBMZNHPSA-N No Yes
20856 Physalin X Physalin X Physalin X C28H30O10 526.184 InChIKey=YANMOPNMEHOFDO-AYFMELEGSA-N No Yes
20857 Physalin X Physalin X Physalin X C28H30O10 526.184 InChIKey=YANMOPNMEHOFDO-AYFMELEGSA-N No Yes
20858 Physalin I Physalin I Physalin I C29H34O10 542.215 InChIKey=NNFMRPSQYZBXBB-RCHSOUIMSA-N No Yes
20859 Physalin II Physalin II Physalin II C29H34O10 542.215 InChIKey=NNFMRPSQYZBXBB-CRFAWBGSSA-N No Yes
20860 (3β,22R)-17-Hydroxy-1,26-dioxo-14,20:22,26-diepoxyergosta-5,24-dien-3-yl β-D-glucopyranoside (3β,22R)-17-Hydroxy-1,26-dioxo-14,20:22,26-diepoxyergosta-5,24-dien-3-yl β-D-glucopyranoside (3β,22R)-17-Hydroxy-1,26-dioxo-14,20:22,26-diepoxyergosta-5,24-dien-3-yl β-D-glucopyranoside C34H48O11 632.320 InChIKey=BVSRDECOTMKNFS-HNIIEEJXSA-N No Yes
20861 C30H40O8 528.272 InChIKey=WVYRGPYKNWCODJ-FRTCLKGASA-N No Yes
20862 C30H40O8 528.272 InChIKey=WVYRGPYKNWCODJ-FKVFAKLNSA-N No Yes
20863 (17S,20R,22R)-4b-Acetyloxy-5b,6b-18,20-diepoxy-18-hydroxy1-oxowitha-2,24-dienolide (17S,20R,22R)-4b-Acetyloxy-5b,6b-18,20-diepoxy-18-hydroxy1-oxowitha-2,24-dienolide (17S,20R,22R)-4b-Acetyloxy-5b,6b-18,20-diepoxy-18-hydroxy1-oxowitha-2,24-dienolide C30H38O8 526.257 InChIKey=UCLKYVACLANLCC-KCTILSLASA-N No Yes
20864 (17S,20R,22R)-4b-Acetyloxy-5b,6b-18,20-diepoxy-18-hydroxy-1-oxowitha-2,24-dienolide (17S,20R,22R)-4b-Acetyloxy-5b,6b-18,20-diepoxy-18-hydroxy-1-oxowitha-2,24-dienolide (17S,20R,22R)-4b-Acetyloxy-5b,6b-18,20-diepoxy-18-hydroxy-1-oxowitha-2,24-dienolide C30H38O8 526.257 InChIKey=UCLKYVACLANLCC-ZZONCJOWSA-N No Yes
20865 (17R,20S,22R)-5b,6b-Epoxy-4b,16x-dihydroxy-1-oxooxowitha-2,24-dienolide (17R,20S,22R)-5b,6b-Epoxy-4b,16x-dihydroxy-1-oxooxowitha-2,24-dienolide (17R,20S,22R)-5b,6b-Epoxy-4b,16x-dihydroxy-1-oxooxowitha-2,24-dienolide C28H38O6 470.267 InChIKey=SRYIGVUIFUEHSZ-LBVAZTCYSA-N No Yes
20866 (17R,20S,22R)-5b,6b-Epoxy-4b,18-dihydroxy-1-oxowitha-2,24-dienolide (17R,20S,22R)-5b,6b-Epoxy-4b,18-dihydroxy-1-oxowitha-2,24-dienolide (17R,20S,22R)-5b,6b-Epoxy-4b,18-dihydroxy-1-oxowitha-2,24-dienolide C28H38O6 470.267 InChIKey=MNTRVOFVGDCIAU-BRMITGIMSA-N No Yes
20867 (17R,20S,22R)-5b,6b-Epoxy-4b,16x-dihydroxy-1,18-didioxowitha-2,24-dienolide (17R,20S,22R)-5b,6b-Epoxy-4b,16x-dihydroxy-1,18-didioxowitha-2,24-dienolide (17R,20S,22R)-5b,6b-Epoxy-4b,16x-dihydroxy-1,18-didioxowitha-2,24-dienolide C28H36O7 484.246 InChIKey=OABPKWQYMBTGLP-DNPMDDLHSA-N No Yes
20868 (2aS,3R,5aR,7aS,7bR,11S,11aS,12aR,13aR,13bS)-3-[(2R,4S,5R)-4,5-Dimethyl-6-oxotetrahydro-2H-pyran-2-yl]-3,7b-dimethyl-5,8-dioxo-1,2,2a,3,6,7,7a,7b,8,11,12a,13,13a,13b-tetradecahydrooxireno[4',4a']napht
ho[2',1':4,5]indeno[1,7a-c]furan-11-yl acetate (2aS,3R,5aR,7aS,7bR,11S,11aS,12aR,13aR,13bS)-3-[(2R,4S,5R)-4,5-Dimethyl-6-oxotetrahydro-2H-pyran-2-yl]-3,7b-dimethyl-5,8-dioxo-1,2,2a,3,6,7,7a,7b,8,11,12a,13,13a,13b-tetradecahydrooxireno[4',4a']napht ho[2',1':4,5]indeno[1,7a-c]furan-11-yl acetate (2aS,3R,5aR,7aS,7bR,11S,11aS,12aR,13aR,13bS)-3-[(2R,4S,5R)-4,5-Dimethyl-6-oxotetrahydro-2H-pyran-2-yl]-3,7b-dimethyl-5,8-dioxo-1,2,2a,3,6,7,7a,7b,8,11,12a,13,13a,13b-tetradecahydrooxireno[4',4a']napht
ho[2',1':4,5]indeno[1,7a-c]furan-11-yl acetate C30H38O8 526.257 InChIKey=DVACOXZKKLKNOU-MLYBQYODSA-N No Yes
20869 (2aS,3R,5aR,7aS,7bR,11S,11aS,12aR,13aR,13bS)-3-[(2R)-4,5-Dimethyl-6-oxo-3,6-dihydro-2H-pyran-2-yl]-3,7b-dimethyl-5,8-dioxo-1,2,2a,3,6,7,7a,7b,8,11,12a,13,13a,13b-tetradecahydrooxireno[4',4a']naphtho[2
',1':4,5]indeno[1,7a-c]furan-11-yl acetate (2aS,3R,5aR,7aS,7bR,11S,11aS,12aR,13aR,13bS)-3-[(2R)-4,5-Dimethyl-6-oxo-3,6-dihydro-2H-pyran-2-yl]-3,7b-dimethyl-5,8-dioxo-1,2,2a,3,6,7,7a,7b,8,11,12a,13,13a,13b-tetradecahydrooxireno[4',4a']naphtho[2 ',1':4,5]indeno[1,7a-c]furan-11-yl acetate (2aS,3R,5aR,7aS,7bR,11S,11aS,12aR,13aR,13bS)-3-[(2R)-4,5-Dimethyl-6-oxo-3,6-dihydro-2H-pyran-2-yl]-3,7b-dimethyl-5,8-dioxo-1,2,2a,3,6,7,7a,7b,8,11,12a,13,13a,13b-tetradecahydrooxireno[4',4a']naphtho[2
',1':4,5]indeno[1,7a-c]furan-11-yl acetate C30H36O8 524.241 InChIKey=IEABCZXUVAYIAD-OAZABPQTSA-N No Yes
20872 Daturolactone 5 Daturolactone 5 Daturolactone 5 C28H40O7 488.277 InChIKey=FRAXEPBUEMOLJG-JJEPUABDSA-N No Yes
20873 Daturolactone 6 Daturolactone 6 Daturolactone 6 C28H40O8 504.272 InChIKey=ZNDWVAWNGJHBAF-JXAVBFHVSA-N No Yes
20874 Daturolactone 7 Daturolactone 7 Daturolactone 7 C28H36O6 468.251 InChIKey=GMKKYUOVUDHFQR-PNSKYDRMSA-N No Yes
20875 ajugin A ajugin A ajugin A C28H38O6 470.267 InChIKey=CMYBEXMBTPRVQX-HZRISEJCSA-N No Yes
20877 Daturalactone-4 Daturalactone-4 Daturalactone-4 C28H38O6 470.267 InChIKey=HMAKYIOVUKVWAW-UQGYZYPHSA-N No Yes
20878 Hyoscyamilactol Hyoscyamilactol Hyoscyamilactol C28H40O6 472.282 InChIKey=WYDFSSCXUGNICP-PPYNTZKFSA-N No Yes
20879 16x-Acetoxyhyoscyamilactol 16x-Acetoxyhyoscyamilactol 16x-Acetoxyhyoscyamilactol C30H42O8 530.288 InChIKey=CFDVWBPMGZMVQC-XEYZXMDGSA-N No Yes
20880 Daturacin Daturacin Daturacin C29H38O6 482.267 InChIKey=NDXDFNUBHFTBTE-DXDCYLRRSA-N No Yes
20881 Cilistol A Cilistol A Cilistol A C28H40O5 456.288 InChIKey=BDZXFCPMKYCHFV-VGYRCYGFSA-N No Yes
20882 Cilistol A Cilistol A Cilistol A C28H40O5 456.288 InChIKey=BDZXFCPMKYCHFV-VGYRCYGFSA-N No Yes
20883 Cilistepoxide Cilistepoxide Cilistepoxide C28H40O6 472.282 InChIKey=UVEUQEVURPOETA-NXNGHOQNSA-N No Yes
20884 22R,24S,25R,26R-1-oxo-22,26;24,25-diepoxy-5α,6β,17α,26-tetrahydroxyergosten-2-ene 22R,24S,25R,26R-1-oxo-22,26;24,25-diepoxy-5α,6β,17α,26-tetrahydroxyergosten-2-ene 22R,24S,25R,26R-1-oxo-22,26;24,25-diepoxy-5α,6β,17α,26-tetrahydroxyergosten-2-ene C28H42O7 490.293 InChIKey=MJPRGJYDDWUFNZ-HUPHSRFFSA-N No Yes