-
(1R,3S,5S,8E,13R)-5,9,13-trimethyl-16-methylidene-4,14-dioxatricyclo[11.3.2.0... Molecule
InChIKey BCEKDLJRXSZZRB-RWQKAGTCSA-N Molecular Formula C20H28O4
Related Dataset(s)
-
(1R,3S,6S)-1,5,5-trimethyl-6-[(1E,3E,5E,7E,9E,11E,13E,15E,17E)-3,7,12,16-tetr... Molecule
InChIKey CMOLUFWHADIFGS-VESOQFFVSA-N Molecular Formula C40H56O2
Related Dataset(s)
-
(1R,3S,6S)-1,5,5-trimethyl-6-[(1E,3E,5E,7E,9E,11E,13E,15E,17E)-3,7,12,16-tetr... Molecule
InChIKey ONQKWANDXQNLEJ-KPJLXDRMSA-N Molecular Formula C40H56O3
Related Dataset(s)
-
(1R,3S,6S)-6-[(1E,3E,5E,7E,9E,11E,13E,15E)-16-[(7aR)-4,4,7a-trimethyl-2,5,6,7... Molecule
InChIKey RXRDUVZIGPRFRB-BEAGFYTDSA-N Molecular Formula C40H56O3
Related Dataset(s)
-
(1R,3S,6S)-6-[(1E,3E,5E,7E,9E,11E,13E,15E,17E)-18-[(1R,4R)-4-hydroxy-2,6,6-tr... Molecule
InChIKey DYUUPIKEWLHQGQ-FJOIUHRLSA-N Molecular Formula C40H56O3
Related Dataset(s)
-
(1R,3S,6S)-6-[(1E,3E,5E,7E,9E,11E,13E,15E,17E)-18-[(1S,4S,6R)-4-hydroxy-2,2,6... Molecule
InChIKey SZCBXWMUOPQSOX-WVJDLNGLSA-N Molecular Formula C40H56O4
Related Dataset(s)
-
(1R,3S,6S)-6-[(1E,3E,5E,7E,9E,11E,13E,15E,17E)-18-[(4R)-4-hydroxy-2,6,6-trime... Molecule
InChIKey OFNSUWBAQRCHAV-OYQUVCAXSA-N Molecular Formula C40H56O3
Related Dataset(s)
-
(1R,3aR,5aR,5bR,7aR,9S,11aR,11bR,13aR,13bR)-3a,5a,5b,8,8,11a-hexamethyl-1-pro... Molecule
InChIKey MQYXUWHLBZFQQO-QGTGJCAVSA-N Molecular Formula C30H50O
Related Dataset(s)
- Lupeol 900MHz 400MHz CDCl3 NMR data[Lupeol_LUPE01_13C.jdx]
- Lupeol 900MHz 400MHz CDCl3 NMR data[3_Lupeol_13CdeptQ]
- Lupeol 900MHz 400MHz CDCl3 NMR data[Lupeol_LUPE01_HMBC_900.jdx]
- Lupeol 900MHz 400MHz CDCl3 NMR data[Lupeol_LUPE01_400_1H.jdx]
- Lupeol 900MHz 400MHz CDCl3 NMR data[Lupeol_LUPE01_400_gCOSY.jdx]
- Lupeol 900MHz 400MHz CDCl3 NMR data[Lupeol_LUPE01_qH.jdf]
- Lupeol 900MHz 400MHz CDCl3 NMR data[4_Lupeol_HSQC]
- Lupeol 900MHz 400MHz CDCl3 NMR data[Lupeol_LUPE01_q1H.jdx]
- Lupeol 900MHz 400MHz CDCl3 NMR data[1_Lupeol_1H]
- Lupeol 900MHz 400MHz CDCl3 NMR data[Lupeol_LUPE01_gCOSY.jdx]
- Lupeol 900MHz 400MHz CDCl3 NMR data[Lupeol_LUPE01_400_HSQC.jdx]
- Lupeol 900MHz 400MHz CDCl3 NMR data[Lupeol_LUPE01_13CdeptQ.jdx]
- Lupeol 900MHz 400MHz CDCl3 NMR data[Lupeol_LUPE01_HMBC_ABS.jdf]
- Lupeol 900MHz 400MHz CDCl3 NMR data[2_Lupeol_gcosy]
- Lupeol 900MHz 400MHz CDCl3 NMR data.hmbc
- Lupeol 900MHz 400MHz CDCl3 NMR data[Lupeol_LUPE01_HSQC.jdf]
- Lupeol 900MHz 400MHz CDCl3 NMR data[Lupeol_LUPE01_HMBC.jdx]
- Lupeol 900MHz 400MHz CDCl3 NMR data[Lupeol_LUPE01_13C.jdf]
- Lupeol 900MHz 400MHz CDCl3 NMR data[Lupeol_LUPE01_gHSQC.jdx]
- Lupeol 900MHz 400MHz CDCl3 NMR data[Lupeol_LUPE01_COSY.jdf]
-
(1R,3aR,5aS,5bR,7aR,9R,11aR,11bR,13aR,13bR)-9-hydroxy-3a,5b,8,8,11a-pentameth... Molecule
InChIKey CLOUCVRNYSHRCF-CHVGUTEKSA-N Molecular Formula C30H48O3
Related Dataset(s)
-
(1R,3aS,5aR,5bR,7aR,9S,11aR,11bR,13aR,13bR)-9-hydroxy-5a,5b,8,8,11a-pentameth... Molecule
InChIKey QGJZLNKBHJESQX-FZFNOLFKSA-N Molecular Formula C30H48O3
Related Dataset(s)
- Betulic acid.aptjmod
- Betulic acid.noesy
- Classics_BetulinicAcid[7]
- Betulic acid.hmbc
- Classics_BetulinicAcid[8]
- Classics_BetulinicAcid[1]
- Classics_BetulinicAcid[6]
- Classics_BetulinicAcid[5]
- Betulic acid.proton
- Betulic acid.cosy
- Classics_BetulinicAcid[4]
- Classics_BetulinicAcid[2]
- Classics_BetulinicAcid[3]
-
(1R,4E,7R,17R)-4-ethylidene-7-hydroxy-7-methyl-6-methylidene-14-oxido-2,9-dio... Molecule
InChIKey COHUFMBRBUPZPA-HPHFTHPTSA-N Molecular Formula C18H23NO6
Related Dataset(s)
- Seneciphylline N-oxide; LC-ESI-ITFT; MS2; CE: 65%; R=15000; [M+H]+
- Seneciphylline N-oxide; LC-ESI-ITFT; MS2; CE: 80%; R=15000; [M+H]+
- Seneciphylline N-oxide; LC-ESI-ITFT; MS2; CE: 60%; R=15000; [M+H]+
- Seneciphylline N-oxide; LC-ESI-ITFT; MS2; CE: 105%; R=15000; [M+H]+
- Seneciphylline N-oxide; LC-ESI-ITFT; MS2; CE: 50%; R=15000; [M+H]+
- Seneciphylline N-oxide; LC-ESI-ITFT; MS2; CE: 45%; R=15000; [M+H]+
- Seneciphylline N-oxide; LC-ESI-ITFT; MS2; CE: 35%; R=15000; [M+H]+
- Seneciphylline N-oxide; LC-ESI-ITFT; MS2; CE: 100%; R=15000; [M+H]+
- Seneciphylline N-oxide; LC-ESI-ITFT; MS2; CE: 55%; R=15000; [M+H]+
- Seneciphylline N-oxide; LC-ESI-ITFT; MS2; CE: 90%; R=15000; [M+H]+
- Seneciphylline N-oxide; LC-ESI-ITFT; MS2; CE: 10%; R=15000; [M+H]+
- Seneciphylline N-oxide; LC-ESI-ITFT; MS2; CE: 70%; R=15000; [M+H]+
- Seneciphylline N-oxide; LC-ESI-ITFT; MS2; CE: 25%; R=15000; [M+H]+
- Seneciphylline N-oxide; LC-ESI-ITFT; MS2; CE: 30%; R=15000; [M+H]+
- Seneciphylline N-oxide; LC-ESI-ITFT; MS2; CE: 75%; R=15000; [M+H]+
- Seneciphylline N-oxide; LC-ESI-ITFT; MS2; CE: 15%; R=15000; [M+H]+
- Seneciphylline N-oxide; LC-ESI-ITFT; MS2; CE: 95%; R=15000; [M+H]+
- Seneciphylline N-oxide; LC-ESI-ITFT; MS2; CE: 85%; R=15000; [M+H]+
- Seneciphylline N-oxide; LC-ESI-ITFT; MS2; CE: 40%; R=15000; [M+H]+
- Seneciphylline N-oxide; LC-ESI-ITFT; MS2; CE: 20%; R=15000; [M+H]+
-
(1R,4R)-1,7,7-trimethylbicyclo[2.2.1]heptan-2-one Molecule
InChIKey DSSYKIVIOFKYAU-XCBNKYQSSA-N Molecular Formula C10H16O
Related Dataset(s)
-
(1R,4R)-1-[(1E,3E,5E,7E,9E,11E,13E,15E)-18-[(4R)-4-hydroxy-2,6,6-trimethylcyc... Molecule
InChIKey HBQMPUHSZHRZGF-WOOBQVQJSA-N Molecular Formula C40H54O3
Related Dataset(s)
-
(1R,4R)-5,6-dihydroxy-4,5,6-trimethyl-2,8-dioxa-13-azatricyclo[8.5.1.013,16]h... Molecule
InChIKey QVCMHGGNRFRMAD-XRQQVQNLSA-N Molecular Formula C16H23NO6
Related Dataset(s)
-
(1R,4R,5R,6R,16R)-5,6-dihydroxy-4,5,6-trimethyl-13-oxido-2,8-dioxa-13-azoniat... Molecule
InChIKey LHVAZUAALQTANZ-ANYXPJNNSA-N Molecular Formula C16H23NO7
Related Dataset(s)
- Monocrotaline N-oxide; LC-ESI-ITFT; MS2; CE: 75%; R=15000; [M+H]+
- Monocrotaline N-oxide; LC-ESI-ITFT; MS2; CE: 60%; R=15000; [M+H]+
- Monocrotaline N-oxide; LC-ESI-ITFT; MS2; CE: 60%; R=15000; [M+H]+
- Monocrotaline N-oxide; LC-ESI-ITFT; MS2; CE: 115%; R=15000; [M+H]+
- Monocrotaline N-oxide; LC-ESI-ITFT; MS2; CE: 55%; R=15000; [M+H]+
- Monocrotaline N-oxide; LC-ESI-ITFT; MS2; CE: 10%; R=15000; [M+H]+
- Monocrotaline N-oxide; LC-ESI-ITFT; MS2; CE: 45%; R=15000; [M+H]+
- Monocrotaline N-oxide; LC-ESI-ITFT; MS2; CE: 25%; R=15000; [M+H]+
- Monocrotaline N-oxide; LC-ESI-ITFT; MS2; CE: 35%; R=15000; [M+H]+
- Monocrotaline N-oxide; LC-ESI-ITFT; MS2; CE: 15%; R=15000; [M+H]+
- Monocrotaline N-oxide; LC-ESI-ITFT; MS2; CE: 35%; R=15000; [M+H]+
- Monocrotaline N-oxide; LC-ESI-ITFT; MS2; CE: 40%; R=15000; [M+H]+
- Monocrotaline N-oxide; LC-ESI-ITFT; MS2; CE: 55%; R=15000; [M+H]+
- Monocrotaline N-oxide; LC-ESI-ITFT; MS2; CE: 20%; R=15000; [M+H]+
- Monocrotaline N-oxide; LC-ESI-ITFT; MS2; CE: 110%; R=15000; [M+H]+
- Monocrotaline N-oxide; LC-ESI-ITFT; MS2; CE: 25%; R=15000; [M+H]+
- Monocrotaline N-oxide; LC-ESI-ITFT; MS2; CE: 70%; R=15000; [M+H]+
- Monocrotaline N-oxide; LC-ESI-ITFT; MS2; CE: 80%; R=15000; [M+H]+
- Monocrotaline N-oxide; LC-ESI-ITFT; MS2; CE: 75%; R=15000; [M+H]+
- Monocrotaline N-oxide; LC-ESI-ITFT; MS2; CE: 50%; R=15000; [M+H]+
- Monocrotaline N-oxide; LC-ESI-ITFT; MS2; CE: 30%; R=15000; [M+H]+
- Monocrotaline N-oxide; LC-ESI-ITFT; MS2; CE: 85%; R=15000; [M+H]+
- Monocrotaline N-oxide; LC-ESI-ITFT; MS2; CE: 100%; R=15000; [M+H]+
- Monocrotaline N-oxide; LC-ESI-ITFT; MS2; CE: 80%; R=15000; [M+H]+
- Monocrotaline N-oxide; LC-ESI-ITFT; MS2; CE: 45%; R=15000; [M+H]+
- Monocrotaline N-oxide; LC-ESI-ITFT; MS2; CE: 65%; R=15000; [M+H]+
- Monocrotaline N-oxide; LC-ESI-ITFT; MS2; CE: 85%; R=15000; [M+H]+
- Monocrotaline N-oxide; LC-ESI-ITFT; MS2; CE: 30%; R=15000; [M+H]+
- Monocrotaline N-oxide; LC-ESI-ITFT; MS2; CE: 70%; R=15000; [M+H]+
- Monocrotaline N-oxide; LC-ESI-ITFT; MS2; CE: 50%; R=15000; [M+H]+
- Monocrotaline N-oxide; LC-ESI-ITFT; MS2; CE: 20%; R=15000; [M+H]+
- Monocrotaline N-oxide; LC-ESI-ITFT; MS2; CE: 40%; R=15000; [M+H]+
- Monocrotaline N-oxide; LC-ESI-ITFT; MS2; CE: 120%; R=15000; [M+H]+
- Monocrotaline N-oxide; LC-ESI-ITFT; MS2; CE: 95%; R=15000; [M+H]+
- Monocrotaline N-oxide; LC-ESI-ITFT; MS2; CE: 15%; R=15000; [M+H]+
- Monocrotaline N-oxide; LC-ESI-ITFT; MS2; CE: 90%; R=15000; [M+H]+
- Monocrotaline N-oxide; LC-ESI-ITFT; MS2; CE: 65%; R=15000; [M+H]+
- Monocrotaline N-oxide; LC-ESI-ITFT; MS2; CE: 90%; R=15000; [M+H]+
-
(1R,4R,5R,6R,16R)-5,6-dihydroxy-4,5,6-trimethyl-2,8-dioxa-13-azatricyclo[8.5.... Molecule
InChIKey QVCMHGGNRFRMAD-XFGHUUIASA-N Molecular Formula C16H23NO6
Related Dataset(s)
- Monocrotaline; LC-ESI-ITFT; MS2; CE: 105%; R=15000; [M+H]+
- Monocrotaline; LC-ESI-ITFT; MS2; CE: 45%; R=15000; [M+H]+
- Monocrotaline; LC-ESI-ITFT; MS2; CE: 25%; R=15000; [M+H]+
- Monocrotaline; LC-ESI-ITFT; MS2; CE: 50%; R=15000; [M+H]+
- Monocrotaline; LC-ESI-ITFT; MS2; CE: 45%; R=15000; [M+H]+
- Monocrotaline; LC-ESI-ITFT; MS2; CE: 30%; R=15000; [M+H]+
- Monocrotaline; LC-ESI-ITFT; MS2; CE: 80%; R=15000; [M+H]+
- Monocrotaline; LC-ESI-ITFT; MS2; CE: 85%; R=15000; [M+H]+
- Monocrotaline; LC-ESI-QTOF; MS; NEGATIVE
- Monocrotaline; LC-ESI-ITFT; MS2; CE: 60%; R=15000; [M+H]+
- Monocrotaline; LC-ESI-ITFT; MS2; CE: 55%; R=15000; [M+H]+
- Monocrotaline; LC-ESI-ITFT; MS2; CE: 95%; R=15000; [M+H]+
- Monocrotaline; LC-ESI-ITFT; MS2; CE: 55%; R=15000; [M+H]+
- Monocrotaline; LC-ESI-ITFT; MS2; CE: 25%; R=15000; [M+H]+
- Monocrotaline; LC-ESI-ITFT; MS2; CE: 35%; R=15000; [M+H]+
- Monocrotaline; LC-ESI-ITFT; MS2; CE: 115%; R=15000; [M+H]+
- Monocrotaline; LC-ESI-ITFT; MS2; CE: 15%; R=15000; [M+H]+
- Monocrotaline; LC-APCI-QTOF; MS; POSITIVE
- Monocrotaline; LC-ESI-ITFT; MS2; CE: 55%; R=15000; [M+H]+
- Monocrotaline; LC-ESI-QTOF; MS; POSITIVE
- Monocrotaline; LC-ESI-ITFT; MS2; CE: 105%; R=15000; [M+H]+
- Monocrotaline; LC-ESI-ITFT; MS2; CE: 120%; R=15000; [M+H]+
- Monocrotaline; LC-ESI-ITFT; MS2; CE: 70%; R=15000; [M+H]+
- Monocrotaline; LC-ESI-ITFT; MS2; CE: 50%; R=15000; [M+H]+
- Monocrotaline; LC-ESI-ITFT; MS2; CE: 30%; R=15000; [M+H]+
- Monocrotaline; LC-ESI-ITFT; MS2; CE: 80%; R=15000; [M+H]+
- Monocrotaline; LC-ESI-ITFT; MS2; CE: 75%; R=15000; [M+H]+
- Monocrotaline; LC-ESI-ITFT; MS2; CE: 40%; R=15000; [M+H]+
- Monocrotaline; LC-ESI-ITFT; MS2; CE: 60%; R=15000; [M+H]+
- Monocrotaline; LC-ESI-ITFT; MS2; CE: 65%; R=15000; [M+H]+
- Monocrotaline; LC-ESI-ITFT; MS2; CE: 60%; R=15000; [M+H]+
- Monocrotaline; LC-ESI-ITFT; MS2; CE: 15%; R=15000; [M+H]+
- Monocrotaline; LC-ESI-ITFT; MS2; CE: 10%; R=15000; [M+H]+
- Monocrotaline; LC-ESI-ITFT; MS2; CE: 45%; R=15000; [M+H]+
- Monocrotaline; LC-ESI-ITFT; MS2; CE: 80%; R=15000; [M+H]+
- Monocrotaline; LC-ESI-ITFT; MS2; CE: 110%; R=15000; [M+H]+
- Monocrotaline; LC-ESI-ITFT; MS2; CE: 95%; R=15000; [M+H]+
- Monocrotaline; LC-ESI-ITFT; MS2; CE: 100%; R=15000; [M+H]+
- Monocrotaline; LC-ESI-ITFT; MS2; CE: 20%; R=15000; [M+H]+
- Monocrotaline; LC-ESI-ITFT; MS2; CE: 35%; R=15000; [M+H]+
- Monocrotaline; LC-ESI-ITFT; MS2; CE: 85%; R=15000; [M+H]+
- Monocrotaline; LC-ESI-ITFT; MS2; CE: 75%; R=15000; [M+H]+
- Monocrotaline; LC-ESI-ITFT; MS2; CE: 15%; R=15000; [M+H]+
- Monocrotaline; LC-ESI-ITFT; MS2; CE: 75%; R=15000; [M+H]+
- Monocrotaline; LC-ESI-ITFT; MS2; CE: 90%; R=15000; [M+H]+
- Monocrotaline; LC-ESI-ITFT; MS2; CE: 25%; R=15000; [M+H]+
- Monocrotaline; LC-ESI-ITFT; MS2; CE: 40%; R=15000; [M+H]+
- Monocrotaline; LC-ESI-ITFT; MS2; CE: 65%; R=15000; [M+H]+
- Monocrotaline; LC-ESI-ITFT; MS2; CE: 70%; R=15000; [M+H]+
- Monocrotaline; LC-ESI-ITFT; MS2; CE: 65%; R=15000; [M+H]+
- Monocrotaline; LC-ESI-ITFT; MS2; CE: 40%; R=15000; [M+H]+
- Monocrotaline; LC-ESI-ITFT; MS2; CE: 10%; R=15000; [M+H]+
- Monocrotaline; LC-ESI-ITFT; MS2; CE: 100%; R=15000; [M+H]+
- Monocrotaline; LC-ESI-ITFT; MS2; CE: 90%; R=15000; [M+H]+
- Monocrotaline; LC-ESI-ITFT; MS2; CE: 30%; R=15000; [M+H]+
- Monocrotaline; LC-ESI-ITFT; MS2; CE: 90%; R=15000; [M+H]+
- Monocrotaline; LC-ESI-ITFT; MS2; CE: 35%; R=15000; [M+H]+
- Monocrotaline; LC-ESI-ITFT; MS2; CE: 20%; R=15000; [M+H]+
- Monocrotaline; LC-ESI-ITFT; MS2; CE: 50%; R=15000; [M+H]+
- Monocrotaline; LC-ESI-ITFT; MS2; CE: 20%; R=15000; [M+H]+
- Monocrotaline; LC-ESI-ITFT; MS2; CE: 70%; R=15000; [M+H]+
- Monocrotaline; LC-ESI-ITFT; MS2; CE: 85%; R=15000; [M+H]+
-
(1R,4S)-1,3,3-trimethylbicyclo[2.2.1]heptan-2-one Molecule
InChIKey LHXDLQBQYFFVNW-OIBJUYFYSA-N Molecular Formula C10H16O
Related Dataset(s)
-
(1R,4S,4'E,5'S,6R,6'S,8R,10E,13R,14E,16E,20R,21R,24S)-21,24-dihydroxy-4'-meth... Molecule
InChIKey YZBLFMPOMVTDJY-LSGXYNIPSA-N Molecular Formula C37H53NO8
Related Dataset(s)
-
(1R,4S,4'E,5'S,6R,8R,10E,13R,14E,16E,20R,21R,24S)-21,24-dihydroxy-4'-methoxyi... Molecule
InChIKey YZBLFMPOMVTDJY-BFPKLJSTSA-N Molecular Formula C37H53NO8
Related Dataset(s)
-
(1R,4S,5'S,6R,6'R,8R,10E,13R,14E,16E,20R,21R,24S)-21,24-dihydroxy-5',6',11,13... Molecule
InChIKey ZLBGSRMUSVULIE-GSMJGMFJSA-N Molecular Formula C31H44O7
Related Dataset(s)