All Compounds in Database

Record Name Formula Exact Mass InChIKey Proton NMR Carbon NMR
2281 nagilactosides C nagilactosides C nagilactosides C C31H44O16 672.263 InChIKey=YKQPHEVALKDZRP-DUKOXAQFSA-N No Yes
2282 nagilactosides D nagilactosides D nagilactosides D C31H44O16 672.263 InChIKey=HALTYQLQMCAMTK-YIVQIOCHSA-N No Yes
2283 nagilactosides E nagilactosides E nagilactosides E C31H44O16 672.263 InChIKey=HLCQNKQLAGJUPK-WDTSDUNHSA-N No Yes
2284 (1aS)-5beta-[(S)-Oxiranyl]-1a,1balpha,2,3,3abeta,4,5,6,7b,8,9,9abeta-dodecahydro-1abeta,5,7bbeta-trimethyl-1H-cyclopropa[a]phenanthrene (1aS)-5beta-[(S)-Oxiranyl]-1a,1balpha,2,3,3abeta,4,5,6,7b,8,9,9abeta-dodecahydro-1abeta,5,7bbeta-trimethyl-1H-cyclopropa[a]phenanthrene (1aS)-5beta-[(S)-Oxiranyl]-1a,1balpha,2,3,3abeta,4,5,6,7b,8,9,9abeta-dodecahydro-1abeta,5,7bbeta-trimethyl-1H-cyclopropa[a]phenanthrene C20H30O1 286.230 InChIKey=XYIJFUAEOWBFQQ-IZSQIBBJSA-N No Yes
2285 (1aS)-1a,1balpha,2,3,3abeta,4,5,6,7b,8,9,9abeta-Dodecahydro-1abeta,5,7bbeta-trimethyl-1H-cyclopropa[a]phenanthrene-5beta-acetaldehyde (1aS)-1a,1balpha,2,3,3abeta,4,5,6,7b,8,9,9abeta-Dodecahydro-1abeta,5,7bbeta-trimethyl-1H-cyclopropa[a]phenanthrene-5beta-acetaldehyde (1aS)-1a,1balpha,2,3,3abeta,4,5,6,7b,8,9,9abeta-Dodecahydro-1abeta,5,7bbeta-trimethyl-1H-cyclopropa[a]phenanthrene-5beta-acetaldehyde C20H30O1 286.230 InChIKey=BCKQSEXULHMIJG-ZPNQOMQUSA-N No Yes
2286 (2aS,2bS,4R,4aR,6S,8bR,10R,10aS)-2a,4-Dihydroxy-6,8b-dimethyl-6-[(2S)-2-oxiranyl]-1,2,2a,2b,3,4,4a,5,6,7,8b,9,10,10a-tetradecahydrocyclobuta[a]phenanthren-10-yl acetate (2aS,2bS,4R,4aR,6S,8bR,10R,10aS)-2a,4-Dihydroxy-6,8b-dimethyl-6-[(2S)-2-oxiranyl]-1,2,2a,2b,3,4,4a,5,6,7,8b,9,10,10a-tetradecahydrocyclobuta[a]phenanthren-10-yl acetate (2aS,2bS,4R,4aR,6S,8bR,10R,10aS)-2a,4-Dihydroxy-6,8b-dimethyl-6-[(2S)-2-oxiranyl]-1,2,2a,2b,3,4,4a,5,6,7,8b,9,10,10a-tetradecahydrocyclobuta[a]phenanthren-10-yl acetate C22H32O5 376.225 InChIKey=DJGOPHAVPKQDCJ-DBXCXYEUSA-N No Yes
2289 12,13-dehydrogeranylgeraniol 12,13-dehydrogeranylgeraniol 12,13-dehydrogeranylgeraniol C20H32O1 288.245 InChIKey=OTYIYOOKHMFXBC-UBZGHHIISA-N No Yes
2290 Boletinin A Boletinin A Boletinin A C20H34O3 322.251 InChIKey=QVPAFHFVRMUTMO-AOMRLLSLSA-N No Yes
2291 Boletinin B Boletinin B Boletinin B C20H34O3 322.251 InChIKey=QBSXZZOSIOENJV-RVIGLEPGSA-N No Yes
2292 Boletinin C Boletinin C Boletinin C C20H34O3 322.251 InChIKey=SLESHBGGKCSEJE-DVKPPUIYSA-N No Yes
2293 Boletinin D Boletinin D Boletinin D C20H34O3 322.251 InChIKey=VFIAQLHHYUJOJN-RCZDYDGJSA-N No Yes
2294 Boletinin E Boletinin E Boletinin E C24H36O5 404.256 InChIKey=AEHIZBVRKDBILT-KCSPCAOWSA-N No Yes
2295 Boletinin F Boletinin F Boletinin F C24H36O5 404.256 InChIKey=UZHMDKVEUKIXIG-KCSPCAOWSA-N No Yes
2296 Boletinin G Boletinin G Boletinin G C24H34O5 402.241 InChIKey=IPFUHLGHDLEPJG-KCSPCAOWSA-N No Yes
2297 Boletinin H Boletinin H Boletinin H C24H34O6 418.236 InChIKey=ZGKBVLVSZSECNY-PAUNICHOSA-N No Yes
2298 Boletinin I Boletinin I Boletinin I C25H36O5 416.256 InChIKey=AOJDLUWCHJXNCH-SDWHTVMGSA-N No Yes
2299 Boletinin J Boletinin J Boletinin J C25H36O6 432.251 InChIKey=RGDGFPUBWJTQHJ-HGJUBKMSSA-N No Yes
2300 Eleganolone Eleganolone Eleganolone C20H32O2 304.240 InChIKey=HJFXJURSUUYZPR-GDVLXBNMSA-N No Yes
2301 Eleganolone Eleganolone Eleganolone C20H32O2 304.240 InChIKey=HJFXJURSUUYZPR-GDVLXBNMSA-N No Yes
2302 (6E,10E,14E)-16-Hydroxy-2,6,10,14-tetramethyl-6,10,14-hexadecatriene-4-one (6E,10E,14E)-16-Hydroxy-2,6,10,14-tetramethyl-6,10,14-hexadecatriene-4-one (6E,10E,14E)-16-Hydroxy-2,6,10,14-tetramethyl-6,10,14-hexadecatriene-4-one C20H34O2 306.256 InChIKey=OMLCVLLJDMSGPQ-GDVLXBNMSA-N No Yes
2303 (6E,10E,14E)-16-Hydroxy-2,6,10,14-tetramethyl-6,10,14-hexadecatriene-4-one (6E,10E,14E)-16-Hydroxy-2,6,10,14-tetramethyl-6,10,14-hexadecatriene-4-one (6E,10E,14E)-16-Hydroxy-2,6,10,14-tetramethyl-6,10,14-hexadecatriene-4-one C20H34O2 306.256 InChIKey=OMLCVLLJDMSGPQ-GDVLXBNMSA-N No Yes
2304 (6E,14E)-16-Hydroxy-10-methylene-2,6,14-trimethyl-2,6,14-hexadecatriene-4,11-dione (6E,14E)-16-Hydroxy-10-methylene-2,6,14-trimethyl-2,6,14-hexadecatriene-4,11-dione (6E,14E)-16-Hydroxy-10-methylene-2,6,14-trimethyl-2,6,14-hexadecatriene-4,11-dione C20H30O3 318.219 InChIKey=QFUAYNMUBFLHQN-UPVCKODDSA-N No Yes
2305 (6E,14E)-16-Acetoxy-10-methylene-2,6,14-trimethyl-2,6,14-hexadecatriene-4,11-dione (6E,14E)-16-Acetoxy-10-methylene-2,6,14-trimethyl-2,6,14-hexadecatriene-4,11-dione (6E,14E)-16-Acetoxy-10-methylene-2,6,14-trimethyl-2,6,14-hexadecatriene-4,11-dione C22H32O4 360.230 InChIKey=NAWDPRCDXGNUNV-YDBXTPAVSA-N No Yes
2306 (6E,14E)-16-Acetoxy-10-methylene-2,6,14-trimethyl-2,6,14-hexadecatriene-4,11-dione (6E,14E)-16-Acetoxy-10-methylene-2,6,14-trimethyl-2,6,14-hexadecatriene-4,11-dione (6E,14E)-16-Acetoxy-10-methylene-2,6,14-trimethyl-2,6,14-hexadecatriene-4,11-dione C22H32O4 360.230 InChIKey=NAWDPRCDXGNUNV-YDBXTPAVSA-N No Yes
2307 2,10,14-Trimethyl-6-methylene-16-acetoxyhexadeca-2,10,14-triene-4,7-dione 2,10,14-Trimethyl-6-methylene-16-acetoxyhexadeca-2,10,14-triene-4,7-dione 2,10,14-Trimethyl-6-methylene-16-acetoxyhexadeca-2,10,14-triene-4,7-dione C22H32O4 360.230 InChIKey=YSAUIJBHWDSQNX-NVJLSHBWSA-N No Yes
2308 2,10,14-Trimethyl-6-methylene-16-acetoxyhexadeca-2,10,14-triene-4,7-dione 2,10,14-Trimethyl-6-methylene-16-acetoxyhexadeca-2,10,14-triene-4,7-dione 2,10,14-Trimethyl-6-methylene-16-acetoxyhexadeca-2,10,14-triene-4,7-dione C22H32O4 360.230 InChIKey=YSAUIJBHWDSQNX-NVJLSHBWSA-N No Yes
2309 Elegandiol Elegandiol Elegandiol C20H34O2 306.256 InChIKey=QYNPSRWEKFVLRS-UYSOGGTPSA-N No Yes
2310 Elegandiol Elegandiol Elegandiol C20H34O2 306.256 InChIKey=QYNPSRWEKFVLRS-UYSOGGTPSA-N No Yes
2311 5-[(3E,7E,10S)-4,8,12-Trimethyl-10-hydroxy-3,7,11-tridecatriene-1-yl]-2,6-dioxabicyclo[3.1.0]hexane-3-one 5-[(3E,7E,10S)-4,8,12-Trimethyl-10-hydroxy-3,7,11-tridecatriene-1-yl]-2,6-dioxabicyclo[3.1.0]hexane-3-one 5-[(3E,7E,10S)-4,8,12-Trimethyl-10-hydroxy-3,7,11-tridecatriene-1-yl]-2,6-dioxabicyclo[3.1.0]hexane-3-one C20H30O4 334.214 InChIKey=SWUAXGSRSQMBTG-JKRLADCNSA-N No Yes
2312 5-[(3E,7E,10S)-4,8,12-Trimethyl-10-hydroxy-3,7,11-tridecatriene-1-yl]-2,6-dioxabicyclo[3.1.0]hexane-3-one 5-[(3E,7E,10S)-4,8,12-Trimethyl-10-hydroxy-3,7,11-tridecatriene-1-yl]-2,6-dioxabicyclo[3.1.0]hexane-3-one 5-[(3E,7E,10S)-4,8,12-Trimethyl-10-hydroxy-3,7,11-tridecatriene-1-yl]-2,6-dioxabicyclo[3.1.0]hexane-3-one C20H30O4 334.214 InChIKey=SWUAXGSRSQMBTG-JKRLADCNSA-N No Yes
2313 (S)-12-Hydroxygeranylgeranic acid (S)-12-Hydroxygeranylgeranic acid (S)-12-Hydroxygeranylgeranic acid C20H32O3 320.235 InChIKey=WUTNFDVILUENNQ-HBSSDYDPSA-N No Yes
2314 (S)-12-hydroxygeranylgeranic acid Methyl ester (S)-12-hydroxygeranylgeranic acid Methyl ester (S)-12-hydroxygeranylgeranic acid Methyl ester C21H34O3 334.251 InChIKey=HCXCHLMRBYGRPU-HMONXFHISA-N No Yes
2315 (2E,6E,9E,11E)-3,7,11,15-Tetramethyl-2,6,9,11,14-hexadecapentene-1-ol (2E,6E,9E,11E)-3,7,11,15-Tetramethyl-2,6,9,11,14-hexadecapentene-1-ol (2E,6E,9E,11E)-3,7,11,15-Tetramethyl-2,6,9,11,14-hexadecapentene-1-ol C20H32O1 288.245 InChIKey=GTABLEMMFSLEDL-SZPPTGSDSA-N No Yes
2316 tetramethyl hexadecapentenol tetramethyl hexadecapentenol tetramethyl hexadecapentenol C20H32O1 288.245 InChIKey=JEMJHGRVHLIJQH-NRZXCNHYSA-N No Yes
2317 (2E,6E,10E,12S)-12-Hydroxy-3,7,11,15-tetramethyl-2,6,10,14-hexadecatetraenal (2E,6E,10E,12S)-12-Hydroxy-3,7,11,15-tetramethyl-2,6,10,14-hexadecatetraenal (2E,6E,10E,12S)-12-Hydroxy-3,7,11,15-tetramethyl-2,6,10,14-hexadecatetraenal C20H32O2 304.240 InChIKey=UXONXAKNRFMJGZ-UGGRNDNRSA-N No Yes
2318 (2Z,6E,10E,12S)-12-Hydroxy-3,7,11,15-tetramethyl-2,6,10,14-hexadecatetraenal (2Z,6E,10E,12S)-12-Hydroxy-3,7,11,15-tetramethyl-2,6,10,14-hexadecatetraenal (2Z,6E,10E,12S)-12-Hydroxy-3,7,11,15-tetramethyl-2,6,10,14-hexadecatetraenal C20H32O2 304.240 InChIKey=UXONXAKNRFMJGZ-VIDKXYHOSA-N No Yes
2319 Eleganonal Eleganonal Eleganonal C20H30O2 302.225 InChIKey=GZUWIUZECLXLRW-GDVLXBNMSA-N No Yes
2320 Isoeleganonal Isoeleganonal Isoeleganonal C20H30O2 302.225 InChIKey=GZUWIUZECLXLRW-IOBQTAGVSA-N No Yes
2321 Bifurcane Bifurcane Bifurcane C20H30O2 302.225 InChIKey=LPNXXVJSERXFHP-ZHHWLGTCSA-N No Yes
2322 Epoxyeleoanolacton Epoxyeleoanolacton Epoxyeleoanolacton C20H30O4 334.214 InChIKey=MWCBIZFZQBYZJE-SPOQGDDGSA-N No Yes
2323 Epoxyeleoanolacton Epoxyeleoanolacton Epoxyeleoanolacton C20H30O4 334.214 InChIKey=MWCBIZFZQBYZJE-SPOQGDDGSA-N No Yes
2324 (2E,10E,12R)-3,11,15-Trimethyl-7-methylene-2,10,14-hexadecatriene-1,6,12-triol (2E,10E,12R)-3,11,15-Trimethyl-7-methylene-2,10,14-hexadecatriene-1,6,12-triol (2E,10E,12R)-3,11,15-Trimethyl-7-methylene-2,10,14-hexadecatriene-1,6,12-triol C20H34O3 322.251 InChIKey=OWUDIDPKJUCMTM-YXRHDHNMSA-N No Yes
2325 (2E,10E,12R)-3,7,11,15-Tetramethyl-2,10,14-hexadecatriene-1,7,12-triol (2E,10E,12R)-3,7,11,15-Tetramethyl-2,10,14-hexadecatriene-1,7,12-triol (2E,10E,12R)-3,7,11,15-Tetramethyl-2,10,14-hexadecatriene-1,7,12-triol C20H36O3 324.266 InChIKey=SJHOVDRDQMNUHW-OETXVDTOSA-N No Yes
2326 bifurcadiol bifurcadiol bifurcadiol C20H34O2 306.256 InChIKey=CHBFGYKXOFQFQP-SPJNFEJNSA-N No Yes
2327 (6E,10E,14E)-2,16-Dihydroxy-2,6,10,14-tetramethyl-6,10,14-hexadecatriene-4-one (6E,10E,14E)-2,16-Dihydroxy-2,6,10,14-tetramethyl-6,10,14-hexadecatriene-4-one (6E,10E,14E)-2,16-Dihydroxy-2,6,10,14-tetramethyl-6,10,14-hexadecatriene-4-one C20H34O3 322.251 InChIKey=IITSMQIGSPWBLH-SZPHWZFISA-N No Yes
2328 (6E,10E)-2,6,10-Trimethyl-14-(1,2-dihydroxyethyl)-2,6,10,14-pentadecatetraene-4-one (6E,10E)-2,6,10-Trimethyl-14-(1,2-dihydroxyethyl)-2,6,10,14-pentadecatetraene-4-one (6E,10E)-2,6,10-Trimethyl-14-(1,2-dihydroxyethyl)-2,6,10,14-pentadecatetraene-4-one C20H32O3 320.235 InChIKey=WALNBYJTLJXJLX-CZCYGEDCSA-N No Yes
2329 (6E,14E)-2,6,14-Trimethyl-10-methylene-11,16-dihydroxy-6,14-hexadecadiene-4-one (6E,14E)-2,6,14-Trimethyl-10-methylene-11,16-dihydroxy-6,14-hexadecadiene-4-one (6E,14E)-2,6,14-Trimethyl-10-methylene-11,16-dihydroxy-6,14-hexadecadiene-4-one C20H34O3 322.251 InChIKey=VKHDETPVJBOHTK-UPVCKODDSA-N No Yes
2330 (2E,10E,13R)-3,11,15-Trimethyl-7-methylene-2,10,14-hexadecatriene-1,6,13-triol (2E,10E,13R)-3,11,15-Trimethyl-7-methylene-2,10,14-hexadecatriene-1,6,13-triol (2E,10E,13R)-3,11,15-Trimethyl-7-methylene-2,10,14-hexadecatriene-1,6,13-triol C20H34O3 322.251 InChIKey=DMYRJIPUYNBFRS-IYXDNUOGSA-N No Yes
2331 (2E,5E,10E,13R)-3,7,11,15-Tetramethyl-2,5,10,14-hexadecatetraene-1,7,13-triol (2E,5E,10E,13R)-3,7,11,15-Tetramethyl-2,5,10,14-hexadecatetraene-1,7,13-triol (2E,5E,10E,13R)-3,7,11,15-Tetramethyl-2,5,10,14-hexadecatetraene-1,7,13-triol C20H34O3 322.251 InChIKey=XVUHXGFVXWXCFD-AKURTTJNSA-N No Yes
2332 (6E,14E)-2,6,14-Trimethyl-10-methylene-11,16-dihydroxy-2,6,14-hexadecatriene-4-one (6E,14E)-2,6,14-Trimethyl-10-methylene-11,16-dihydroxy-2,6,14-hexadecatriene-4-one (6E,14E)-2,6,14-Trimethyl-10-methylene-11,16-dihydroxy-2,6,14-hexadecatriene-4-one C20H32O3 320.235 InChIKey=UAAZTLQDFUORHE-UPVCKODDSA-N No Yes