All Compounds in Database

Record Name Formula Exact Mass InChIKey Proton NMR Carbon NMR
20885 16,24-Cyclo-13,14-secoergosta-18,26-dioic acid-14:17,14:27-diepoxy-11β,13,20,22-tetrahydroxy-5α-methoxy-1,15-dioxo-γ-lactone  δ-lactone 16,24-Cyclo-13,14-secoergosta-18,26-dioic acid-14:17,14:27-diepoxy-11β,13,20,22-tetrahydroxy-5α-methoxy-1,15-dioxo-γ-lactone δ-lactone 16,24-Cyclo-13,14-secoergosta-18,26-dioic acid-14:17,14:27-diepoxy-11β,13,20,22-tetrahydroxy-5α-methoxy-1,15-dioxo-γ-lactone  δ-lactone C29H34O11 558.210 InChIKey=QMUPPTLVOVRXRI-OMFQAITISA-N No Yes
20886 16,24-Cyclo-13,14-secoergosta-2-ene-18,26-dioicacid-14:17,14:27-diepoxy-5a,11b,13,20,22-pentahydroxy-1,6,15-trioxo-γ-lactone δ-lactone 16,24-Cyclo-13,14-secoergosta-2-ene-18,26-dioicacid-14:17,14:27-diepoxy-5a,11b,13,20,22-pentahydroxy-1,6,15-trioxo-γ-lactone δ-lactone 16,24-Cyclo-13,14-secoergosta-2-ene-18,26-dioicacid-14:17,14:27-diepoxy-5a,11b,13,20,22-pentahydroxy-1,6,15-trioxo-γ-lactone δ-lactone C28H30O12 558.174 InChIKey=QKUKJZORBVIWEJ-VIDWNLMWSA-N No Yes
20888 Withanoside I Withanoside I Withanoside I C34H52O11 636.351 InChIKey=ICLOJOVMWXAYEI-NIIDGZEBSA-N No Yes
20889 Withanoside II Withanoside II Withanoside II C40H62O16 798.404 InChIKey=BXRJZGQBQZINGV-LGYZFUPKSA-N No Yes
20890 Withanoside III Withanoside III Withanoside III C34H52O12 652.346 InChIKey=RRWWSMHWDKRGQC-MUDBZRFRSA-N No Yes
20891 Withanoside IV Withanoside IV Withanoside IV C40H62O15 782.409 InChIKey=VUQQGHSDHGOYRH-IFUSOADVSA-N No Yes
20892 Withanoside V Withanoside V Withanoside V C40H62O14 766.414 InChIKey=ZBLWKSUMHLVXAM-KFJRISAASA-N No Yes
20893 Withanoside VI Withanoside VI Withanoside VI C40H62O15 782.409 InChIKey=MKCYAASFWFGIJK-BWBMWEGTSA-N No Yes
20894 Withanoside VII Withanoside VII Withanoside VII C40H62O15 782.409 InChIKey=ZYUUDMNYEWKQSN-VSYHLBNMSA-N No Yes
20895 Withagenins A Withagenins A Withagenins A C28H42O7 490.293 InChIKey=ODDVRQILILRIDU-VMKBHCCJSA-N No Yes
20896 Withagenins B Withagenins B Withagenins B C28H42O5 458.303 InChIKey=UYWVGWCAWOZFDB-CGRVPVJYSA-N No Yes
20897 (-)-2-geranyl-3-hydroxy-8,9-ethylenedioxypterocarpan (-)-2-geranyl-3-hydroxy-8,9-ethylenedioxypterocarpan (-)-2-geranyl-3-hydroxy-8,9-ethylenedioxypterocarpan C26H28O5 420.194 InChIKey=GWPLWWRLEHMIPE-HPRYFGGTSA-N No Yes
20898 (17S,20S,22R)-14a,15a,17b,20b-tetrahydroxy-1-oxowitha-2,5,24-trienolide (17S,20S,22R)-14a,15a,17b,20b-tetrahydroxy-1-oxowitha-2,5,24-trienolide (17S,20S,22R)-14a,15a,17b,20b-tetrahydroxy-1-oxowitha-2,5,24-trienolide C28H38O7 486.262 InChIKey=XAEUKOBJPRGERY-VLXOZLMASA-N No Yes
20899 (4β,5β,6β,8ξ,9ξ,14β,15α,16β,17β)-17-{(1R)-1-[(2R)-4,5-Dimethyl-6-oxo-3,6-dihydro-2H-pyran-2-yl]ethyl}-4,14-dihydroxy-1-oxo-5,6:16,17-diepoxyandrost-2-en-15-yl acetate (4β,5β,6β,8ξ,9ξ,14β,15α,16β,17β)-17-{(1R)-1-[(2R)-4,5-Dimethyl-6-oxo-3,6-dihydro-2H-pyran-2-yl]ethyl}-4,14-dihydroxy-1-oxo-5,6:16,17-diepoxyandrost-2-en-15-yl acetate (4β,5β,6β,8ξ,9ξ,14β,15α,16β,17β)-17-{(1R)-1-[(2R)-4,5-Dimethyl-6-oxo-3,6-dihydro-2H-pyran-2-yl]ethyl}-4,14-dihydroxy-1-oxo-5,6:16,17-diepoxyandrost-2-en-15-yl acetate C30H38O9 542.252 InChIKey=VVQRJFUYBNCTQX-STRQQOONSA-N No Yes
20900 C30H38O8 526.257 InChIKey=OZZNUJSEIHDCFJ-UXNBTRKISA-N No Yes
20902 (5α,6β,14β,15α,16β,17α,22R)-5,6,14-Trihydroxy-1,26-dioxo-16,17:22,26-diepoxyergosta-2,24-dien-15-yl acetate (5α,6β,14β,15α,16β,17α,22R)-5,6,14-Trihydroxy-1,26-dioxo-16,17:22,26-diepoxyergosta-2,24-dien-15-yl acetate (5α,6β,14β,15α,16β,17α,22R)-5,6,14-Trihydroxy-1,26-dioxo-16,17:22,26-diepoxyergosta-2,24-dien-15-yl acetate C30H40O9 544.267 InChIKey=XIINLGCQYPFDPD-GCGXNVHFSA-N No Yes
20903 Physagulin J Physagulin J Physagulin J C30H42O8 530.288 InChIKey=LPLXJRLTDNXTSA-LYDDYJSBSA-N No Yes
20904 Physagulin K Physagulin K Physagulin K C30H42O9 546.283 InChIKey=URZHQDOZWJFQSH-SXLGBMPDSA-N No Yes
20905 Bracteosin A Bracteosin A Bracteosin A C29H42O7 502.293 InChIKey=HCYYYEATDHYCPB-JYZRLJDXSA-N No Yes
20906 Bracteosin B Bracteosin B Bracteosin B C29H40O9 532.267 InChIKey=RCAHXMJAUURLOY-FOJHVNBFSA-N No Yes
20907 Bracteosin C Bracteosin C Bracteosin C C29H44O7 504.309 InChIKey=NFIMFHSRXCLQOT-FCDJUPLXSA-N No Yes
20908 16,24-Cyclo-13,14-secoergost-2-ene-18,26-dioic Acid 14:17,14:27-Diepoxy-5α,6β,11β,13,20,22-hexahydroxy-1,15-dioxo-γ-lactone 16,24-Cyclo-13,14-secoergost-2-ene-18,26-dioic Acid 14:17,14:27-Diepoxy-5α,6β,11β,13,20,22-hexahydroxy-1,15-dioxo-γ-lactone 16,24-Cyclo-13,14-secoergost-2-ene-18,26-dioic Acid 14:17,14:27-Diepoxy-5α,6β,11β,13,20,22-hexahydroxy-1,15-dioxo-γ-lactone C28H32O12 560.189 InChIKey=TVJCXNHCDJLAKM-IQFXVIQUSA-N No Yes
20909 16,24-Cyclo-13,14-secoergost-2-ene-18,26-dioic Acid 14:17,14:27-Diepoxy-5,13,20,22-tetrahydroxy-1,15-dioxo- -lactone  -Lactone 16,24-Cyclo-13,14-secoergost-2-ene-18,26-dioic Acid 14:17,14:27-Diepoxy-5,13,20,22-tetrahydroxy-1,15-dioxo- -lactone -Lactone 16,24-Cyclo-13,14-secoergost-2-ene-18,26-dioic Acid 14:17,14:27-Diepoxy-5,13,20,22-tetrahydroxy-1,15-dioxo- -lactone  -Lactone C28H32O10 528.200 InChIKey=YLSUZBFZMRUNLW-IBXLOAICSA-N No Yes
20911 Isophysalin B Isophysalin B Isophysalin B C28H30O9 510.189 InChIKey=HRUAQJXBUYEBPK-LZHDCEGLSA-N No Yes
20912 5,6-Epoxyphysalin B 5,6-Epoxyphysalin B 5,6-Epoxyphysalin B C28H30O10 526.184 InChIKey=VSLWNSSUMFSGFF-UWHPKIKVSA-N No Yes
20913 Daturametelins H Daturametelins H Daturametelins H C34H46O9 598.314 InChIKey=FRPYXURUKGDIHX-ZOMDGWCMSA-N No Yes
20914 Daturametelins I Daturametelins I Daturametelins I C34H48O10 616.325 InChIKey=ZKPXDCPRHDFPTL-UWOSJZGMSA-N No Yes
20915 Daturametelins J Daturametelins J Daturametelins J C34H48O11 632.320 InChIKey=UJZXCVBHMSNJPA-FGAQVDCESA-N No Yes
20916 Daturataturin A Daturataturin A Daturataturin A C34H48O10 616.325 InChIKey=FYXDMSFPWCORTF-UWOSJZGMSA-N No Yes
20917 7,27-dihydroxy-1-oxowitha-2,5,24-trienolide 7,27-dihydroxy-1-oxowitha-2,5,24-trienolide 7,27-dihydroxy-1-oxowitha-2,5,24-trienolide C28H38O5 454.272 InChIKey=UKCDPEQADUKCDH-NQNHUYFBSA-N No Yes
20918 Physagulins L Physagulins L Physagulins L C30H38O7 510.262 InChIKey=YJDKOHBJNZGVGR-RYRGEWKHSA-N No Yes
20919 Physagulins M Physagulins M Physagulins M C30H40O8 528.272 InChIKey=LLYDHEDUPGJUDM-AMZRSCAFSA-N No Yes
20920 Physagulins N Physagulins N Physagulins N C28H40O7 488.277 InChIKey=FBDDCGIZSNPIGK-GSXKAVFKSA-N No Yes
20921 Physagulins O Physagulins O Physagulins O C30H40O9 544.267 InChIKey=OMXOYSUYNDLNQT-XFZRHVTASA-N No Yes
20922 Physagulin K Physagulin K Physagulin K C30H42O9 546.283 InChIKey=URZHQDOZWJFQSH-SXLGBMPDSA-N No Yes
20923 Withaminimin Withaminimin Withaminimin C30H40O8 528.272 InChIKey=REOWXEUUAXLCRM-DTRRUJLXSA-N No Yes
20924 Physagulin J Physagulin J Physagulin J C30H42O8 530.288 InChIKey=LPLXJRLTDNXTSA-LYDDYJSBSA-N No Yes
20925 Withacoagulins A Withacoagulins A Withacoagulins A C28H36O5 452.256 InChIKey=IIFVFTBYLNRNON-XLUXOEGYSA-N No Yes
20926 Withacoagulins B Withacoagulins B Withacoagulins B C28H36O5 452.256 InChIKey=CCRDHRZKGQBDGC-ZOKBQHMGSA-N No Yes
20927 Withacoagulins C Withacoagulins C Withacoagulins C C28H38O7 486.262 InChIKey=QKOOJURCARFMON-VLXOZLMASA-N No Yes
20928 Withacoagulins D Withacoagulins D Withacoagulins D C28H38O7 486.262 InChIKey=NOFNARPLYQSKHE-WEJNEFSASA-N No Yes
20929 Withacoagulins E Withacoagulins E Withacoagulins E C28H38O5 454.272 InChIKey=ZRJOVYPUBHQEES-XXMWMNJKSA-N No Yes
20930 Withacoagulins F Withacoagulins F Withacoagulins F C28H38O5 454.272 InChIKey=LEVWMALVAZUERI-XXMWMNJKSA-N No Yes
20931 5a-hydroxy-25,27-dihydro-4,7-didehydro-7-deoxyneophysalin A 5a-hydroxy-25,27-dihydro-4,7-didehydro-7-deoxyneophysalin A 5a-hydroxy-25,27-dihydro-4,7-didehydro-7-deoxyneophysalin A C28H32O10 528.200 InChIKey=AIXIQYHKQUCEBO-CXAXPQMTSA-N No Yes
20932 Cilistol p Cilistol p Cilistol p C34H54O12 654.362 InChIKey=TVYDUTRHCCOMJI-PLINPJSQSA-N No Yes
20933 Cilistol pm Cilistol pm Cilistol pm C35H56O12 668.377 InChIKey=QTOQLZOZLCKYND-UDJWBFFWSA-N No Yes
20934 Cilistol p1 Cilistol p1 Cilistol p1 C35H56O12 668.377 InChIKey=WFEKSECTGHHFOF-UDJWBFFWSA-N No Yes
20935 Cilistol u Cilistol u Cilistol u C34H52O11 636.351 InChIKey=LJRMCCIMYSLSCN-DXIQTVFXSA-N No Yes
20936 Cilistols v Cilistols v Cilistols v C34H56O9 608.392 InChIKey=XWYAVJLVMRZBFM-YFKVRHPMSA-N No Yes
20937 Cilistols t Cilistols t Cilistols t C34H54O10 622.372 InChIKey=MNFQTDOKETXTKR-SLUKKYMLSA-N No Yes