All Compounds in Database

Record Name Formula Exact Mass InChIKey Proton NMR Carbon NMR
5785 [(2R,3S)-2,3-Dihydroxy-3-(hydroxymethyl)butyl]beta-D-fructofuranoside [(2R,3S)-2,3-Dihydroxy-3-(hydroxymethyl)butyl]beta-D-fructofuranoside [(2R,3S)-2,3-Dihydroxy-3-(hydroxymethyl)butyl]beta-D-fructofuranoside C11H22O9 298.126 InChIKey=GCKVCNACVKQGOU-UPMLMMEUSA-N No Yes
5786 [(2S,3R)-2-Methyl-2,3,4-trihydroxybutyl]6-O-(4-hydroxybenzoyl)-beta-D-glucopyranoside [(2S,3R)-2-Methyl-2,3,4-trihydroxybutyl]6-O-(4-hydroxybenzoyl)-beta-D-glucopyranoside [(2S,3R)-2-Methyl-2,3,4-trihydroxybutyl]6-O-(4-hydroxybenzoyl)-beta-D-glucopyranoside C18H26O11 418.148 InChIKey=WEDHAYWWGPSQDM-VTODNCJKSA-N No Yes
5787 [(2S,3R)-2-Methyl-2,3,4-trihydroxybutyl]6-O-(4-methoxybenzoyl)-beta-D-glucopyranoside [(2S,3R)-2-Methyl-2,3,4-trihydroxybutyl]6-O-(4-methoxybenzoyl)-beta-D-glucopyranoside [(2S,3R)-2-Methyl-2,3,4-trihydroxybutyl]6-O-(4-methoxybenzoyl)-beta-D-glucopyranoside C19H28O11 432.163 InChIKey=CXRFMTJPRLMTOT-LHVZWHSTSA-N No Yes
5788 19-Nortestosterone 19-Nortestosterone 19-Nortestosterone C18H24O3 288.173 InChIKey=LIHCHNCKGJOZKD-FTAMUGHTSA-N No Yes
5789 1-Dehydrotestosterone 1-Dehydrotestosterone 1-Dehydrotestosterone C19H26O3 302.188 InChIKey=AMMCJHLYDWYYKQ-RCFCFVIZSA-N No Yes
5790 3beta-trans-Sinapoyloxylup-20(29)-en-28-ol 3beta-trans-Sinapoyloxylup-20(29)-en-28-ol 3beta-trans-Sinapoyloxylup-20(29)-en-28-ol C41H60O6 648.439 InChIKey=FUWIZRPADCCJBJ-XTAFKLMRSA-N No Yes
5791 3beta-trans-Feruloyloxy-16beta-hydroxylup-20(29)-en 3beta-trans-Feruloyloxy-16beta-hydroxylup-20(29)-en 3beta-trans-Feruloyloxy-16beta-hydroxylup-20(29)-en C40H58O5 618.428 InChIKey=VTXNMTBJJJVGHJ-CJINECEASA-N No Yes
5792 Revandchinone-1 Revandchinone-1 Revandchinone-1 C34H48O6 552.345 InChIKey=LAPBTKRINITSRX-UHFFFAOYSA-N No Yes
5793 Revandchine-2 Revandchine-2 Revandchine-2 C43H64O5 660.475 InChIKey=KCXOKDXLQOFYJH-WUKNDPDISA-N No Yes
5794 Revandchinone-3 Revandchinone-3 Revandchinone-3 C37H54O5 578.397 InChIKey=PASFAROVHZSTNQ-UHFFFAOYSA-N No Yes
5795 Revandchinone-4 Revandchinone-4 Revandchinone-4 C33H48O7 556.340 InChIKey=ABZUEKDPGNIZLP-UHFFFAOYSA-N No Yes
5796 Guggulsterone-M Guggulsterone-M Guggulsterone-M C22H30O3 342.219 InChIKey=WOVLRQSWILBDQL-HVFOMWKBSA-N No Yes
5797 Dehydroguggulsterone-M Dehydroguggulsterone-M Dehydroguggulsterone-M C22H28O3 340.204 InChIKey=VODVRLMPRRXINS-HVFOMWKBSA-N No Yes
5798 Guggulsterol-Y Guggulsterol-Y Guggulsterol-Y C27H46O4 434.340 InChIKey=KQTBMRBMNBEPAZ-WPLNPXAKSA-N No Yes
5799 6-Hydroxyapigenin 6-Hydroxyapigenin 6-Hydroxyapigenin C21H20O11 448.101 InChIKey=VUGRLRAUZWGZJP-IAAKTDFRSA-N No Yes
5800 6-Hydroxyluteolin 6-Hydroxyluteolin 6-Hydroxyluteolin C15H10O7 302.043 InChIKey=VYAKIUWQLHRZGK-UHFFFAOYSA-N No Yes
5802 Kaempferol 3-O-(2''-O-a-rhamnosyl-6''-O-malonyl)-b-glucoside Kaempferol 3-O-(2''-O-a-rhamnosyl-6''-O-malonyl)-b-glucoside Kaempferol 3-O-(2''-O-a-rhamnosyl-6''-O-malonyl)-b-glucoside C30H32O18 680.159 InChIKey=JTOOPMHFLOLUPJ-KJCFOITISA-N No Yes
5804 Quercetin 3-O-(2''-O-a-rhamnosyl-6''-O-malonyl)-b-glucoside Quercetin 3-O-(2''-O-a-rhamnosyl-6''-O-malonyl)-b-glucoside Quercetin 3-O-(2''-O-a-rhamnosyl-6''-O-malonyl)-b-glucoside C30H32O19 696.154 InChIKey=NTHFGJOIFSTXSI-ADXAMWANSA-N No Yes
5805 Myricetin 3-O-(2'',6''-di-O-a-rhamnosyl)-b-glucoside Myricetin 3-O-(2'',6''-di-O-a-rhamnosyl)-b-glucoside Myricetin 3-O-(2'',6''-di-O-a-rhamnosyl)-b-glucoside C33H40O21 772.206 InChIKey=DORABKJYWOFZGC-OANINHMYSA-N No Yes
5806 Quercetin 3-(2-rhamnosylrutinoside) Quercetin 3-(2-rhamnosylrutinoside) Quercetin 3-(2-rhamnosylrutinoside) C33H40O20 756.211 InChIKey=HKNBJSRIYRDSLB-SYYFYUCJSA-N No Yes
5807 Kaempferol 3-(2-rhamnosylrutinoside) Kaempferol 3-(2-rhamnosylrutinoside) Kaempferol 3-(2-rhamnosylrutinoside) C33H40O19 740.216 InChIKey=WRXVPTMENPZUIZ-GRBYBHAGSA-N No Yes
5808 kaempferol 3-neohesperidoside kaempferol 3-neohesperidoside kaempferol 3-neohesperidoside C27H30O15 594.158 InChIKey=OHOBPOYHROOXEI-JWEWDLEYSA-N No Yes
5809 Quercetin 3-neohesperidoside Quercetin 3-neohesperidoside Quercetin 3-neohesperidoside C27H30O16 610.153 InChIKey=FYBMGZSDYDNBFX-CAMZQPOMSA-N No Yes
5810 Myricetin 3-neohesperidoside Myricetin 3-neohesperidoside Myricetin 3-neohesperidoside C27H30O17 626.148 InChIKey=LUITYVJNCILVDI-KUFBNUPQSA-N No Yes
5811 Kaempferol-3-O-rutinoside Kaempferol-3-O-rutinoside Kaempferol-3-O-rutinoside C27H30O15 594.158 InChIKey=RTATXGUCZHCSNG-WLPGYADJSA-N No Yes
5812 ZINC28816558 ZINC28816558 ZINC28816558 C27H30O16 610.153 InChIKey=IKGXIBQEEMLURG-DDRMSXOHSA-N No Yes
5813 Myricetin -3-rutinoside Myricetin -3-rutinoside Myricetin -3-rutinoside C27H30O17 626.148 InChIKey=QCIILLDRJZPUDI-WFPAFUNVSA-N No Yes
5814 Astragalin Astragalin Astragalin C21H20O11 448.101 InChIKey=JPUKWEQWGBDDQB-QSOFNFLRSA-N No Yes
5815 Isoquercitrin Isoquercitrin Isoquercitrin C21H20O12 464.095 InChIKey=OVSQVDMCBVZWGM-QSOFNFLRSA-N No Yes
5816 myricetin 3-O-beta-D-glucoside myricetin 3-O-beta-D-glucoside myricetin 3-O-beta-D-glucoside C21H20O13 480.090 InChIKey=FOHXFLPXBUAOJM-LIBJPBHASA-N No Yes
5817 Aporpinone A Aporpinone A Aporpinone A C11H12O4 208.074 InChIKey=OHZIHJXRVSHUBQ-MDZDMXLPSA-N No Yes
5818 4''-hidroxyaporpinone A 4''-hidroxyaporpinone A 4''-hidroxyaporpinone A C11H12O5 224.068 InChIKey=OPUNBWBQUCHJGF-CMDGGOBGSA-N No Yes
5819 Aporpinone B Aporpinone B Aporpinone B C10H8O4 192.042 InChIKey=WYMTWRGLKSMOPA-VQHVLOKHSA-N No Yes
5820 1''-acetylaporpinone B 1''-acetylaporpinone B 1''-acetylaporpinone B C12H10O5 234.053 InChIKey=ACUGOKQSBBMKIL-PKNBQFBNSA-N No Yes
5821 Fusicoserpenol A Fusicoserpenol A Fusicoserpenol A C20H34O2 306.256 InChIKey=HAIFQAQHAROQLN-JWLCQNFESA-N No Yes
5822 Dolabeserpenoic acid A Dolabeserpenoic acid A Dolabeserpenoic acid A C20H30O2 302.225 InChIKey=YQRHFPSCUBKRIZ-RJHYLEMXSA-N No Yes
5825 (-)-trans Blechnic acid (-)-trans Blechnic acid (-)-trans Blechnic acid C18H14O8 358.069 InChIKey=GJHXGOBGPWPCCK-HFPBVCCTSA-N No Yes
5826 (-)-cis Blechnic acid (-)-cis Blechnic acid (-)-cis Blechnic acid C18H14O8 358.069 InChIKey=GJHXGOBGPWPCCK-MCIOBPLBSA-N No Yes
5827 a-Boswellic acid a-Boswellic acid a-Boswellic acid C30H48O3 456.360 InChIKey=BZXULBWGROURAF-IKNLXHIFSA-N No Yes
5828 b-boswellic acid b-boswellic acid b-boswellic acid C30H48O3 456.360 InChIKey=NBGQZFQREPIKMG-PONOSELZSA-N No Yes
5829 lupeolic acid lupeolic acid lupeolic acid C30H48O3 456.360 InChIKey=NYJYXELDYSTZFI-XSDHLHMPSA-N No Yes
5830 3a-hydroxy-lup-20(29)-en-24-oic acid methyl 3a-hydroxy-lup-20(29)-en-24-oic acid methyl 3a-hydroxy-lup-20(29)-en-24-oic acid methyl C31H50O3 470.376 InChIKey=BLIZURZRVPGHSK-QQTFKYAXSA-N No Yes
5831 Acetyllupeolic acid Acetyllupeolic acid Acetyllupeolic acid C32H50O4 498.371 InChIKey=DULLEXJVWYWBKQ-BRSKACALSA-N No Yes
5832 ent-Pimar-15-ene-3 ,8 -diol ent-Pimar-15-ene-3 ,8 -diol ent-Pimar-15-ene-3 ,8 -diol C20H34O2 306.256 InChIKey=UIVFXGICZLHPQO-RQPVFEQBSA-N No Yes
5833 Embelinone Embelinone Embelinone C30H46O3 454.345 InChIKey=LFGMPZUAVBUIDP-FMBAYFKISA-N No Yes
5834 Aegicerin Aegicerin Aegicerin C30H48O3 456.360 InChIKey=HAORCLCFRZGQJZ-FZUFEACKSA-N No Yes
5835 Protoprimulagenin Protoprimulagenin Protoprimulagenin C30H50O3 458.376 InChIKey=LFBHIAAGGTTWAT-DNSXXVLGSA-N No Yes
5836 Schimperinone Schimperinone Schimperinone C30H48O3 456.360 InChIKey=YJVMDLQSCPBESM-ZZAAMMQTSA-N No Yes
5837 Primulagenin A  (3B,16B,28-trihydroxy-12-oleanene) Primulagenin A (3B,16B,28-trihydroxy-12-oleanene) Primulagenin A  (3B,16B,28-trihydroxy-12-oleanene) C30H50O3 458.376 InChIKey=YHGVYECWZWIVJC-TVZJSHMMSA-N No Yes
5838 Thuriferic acid Thuriferic acid Thuriferic acid C22H20O8 412.116 InChIKey=HLSXUNBUCPHTDA-RTBURBONSA-N No Yes