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(10R,13S)-17-acetyl-10,13-dimethyl-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydroc... Molecule
InChIKey RJKFOVLPORLFTN-KKINBUFLSA-N Molecular Formula C21H30O2
Related Dataset(s)
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(10R,13S)-17-hydroxy-10,13-dimethyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclop... Molecule
InChIKey RSIHSRDYCUFFLA-DGGYFRSASA-N Molecular Formula C19H26O2
Related Dataset(s)
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(10R,13S,17R)-17-hydroxy-17-(2-hydroxyacetyl)-10,13-dimethyl-1,2,6,7,8,9,12,1... Molecule
InChIKey MFYSYFVPBJMHGN-BDQMTFAOSA-N Molecular Formula C21H28O5
Related Dataset(s)
-
(10S)-1,8-dihydroxy-3-(hydroxymethyl)-10-[(2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6... Molecule
InChIKey AFHJQYHRLPMKHU-OSYMLPPYSA-N Molecular Formula C21H22O9
Related Dataset(s)
- Aloin A; LC-ESI-ITFT; MS2; CE: 65%; R=15000; [M+H]+
- Aloin A; LC-ESI-ITFT; MS2; CE: 105%; R=15000; [M+H]+
- Aloin A; LC-ESI-ITFT; MS2; CE: 15%; R=15000; [M+H]+
- Aloin A; LC-ESI-ITFT; MS2; CE: 80%; R=15000; [M+H]+
- Aloin A; LC-ESI-ITFT; MS2; CE: 105%; R=15000; [M+H]+
- Aloin A; LC-ESI-ITFT; MS2; CE: 35%; R=15000; [M+H]+
- Aloin A; LC-ESI-ITFT; MS2; CE: 120%; R=15000; [M+H]+
- Aloin A; LC-ESI-ITFT; MS2; CE: 85%; R=15000; [M+H]+
- Aloin A; LC-ESI-ITFT; MS2; CE: 95%; R=15000; [M+H]+
- Aloin A; LC-ESI-ITFT; MS2; CE: 45%; R=15000; [M+H]+
- Aloin A; LC-ESI-ITFT; MS2; CE: 105%; R=15000; [M+H]+
- Aloin A; LC-ESI-ITFT; MS2; CE: 70%; R=15000; [M+H]+
- Barbaloin; LC-ESI-ITTOF; MS; [M+H]+
- Aloin A; LC-ESI-ITFT; MS2; CE: 75%; R=15000; [M+H]+
- Aloin A; LC-ESI-ITFT; MS2; CE: 40%; R=15000; [M+H]+
- Aloin A; LC-ESI-ITFT; MS2; CE: 65%; R=15000; [M+H]+
- Aloin A; LC-ESI-ITFT; MS2; CE: 70%; R=15000; [M+H]+
- Aloin A; LC-ESI-ITFT; MS2; CE: 70%; R=15000; [M+H]+
- Aloin A; LC-ESI-ITFT; MS2; CE: 45%; R=15000; [M+H]+
- Aloin A; LC-ESI-ITFT; MS2; CE: 20%; R=15000; [M+H]+
- Aloin A; LC-ESI-ITFT; MS2; CE: 80%; R=15000; [M+H]+
- Aloin A; LC-ESI-ITFT; MS2; CE: 90%; R=15000; [M+H]+
- Aloin A; LC-ESI-ITFT; MS2; CE: 115%; R=15000; [M+H]+
- Aloin A; LC-ESI-ITFT; MS2; CE: 80%; R=15000; [M+H]+
- Aloin A; LC-ESI-ITFT; MS2; CE: 80%; R=15000; [M+H]+
- Aloin A; LC-ESI-ITFT; MS2; CE: 60%; R=15000; [M+H]+
- Aloin A; LC-ESI-ITFT; MS2; CE: 15%; R=15000; [M+H]+
- Aloin A; LC-ESI-ITFT; MS2; CE: 40%; R=15000; [M+H]+
- Aloin A; LC-ESI-ITFT; MS2; CE: 55%; R=15000; [M+H]+
- Aloin A; LC-ESI-ITFT; MS2; CE: 115%; R=15000; [M+H]+
- Aloin A; LC-ESI-ITFT; MS2; CE: 90%; R=15000; [M+H]+
- Aloin A; LC-ESI-ITFT; MS2; CE: 30%; R=15000; [M+H]+
- Aloin A; LC-ESI-ITFT; MS2; CE: 50%; R=15000; [M+H]+
- Aloin A; LC-ESI-ITFT; MS2; CE: 50%; R=15000; [M+H]+
- Aloin A; LC-ESI-ITFT; MS2; CE: 100%; R=15000; [M+H]+
- Aloin A; LC-ESI-ITFT; MS2; CE: 60%; R=15000; [M+H]+
- Aloin A; LC-ESI-ITFT; MS2; CE: 115%; R=15000; [M+H]+
- Aloin A; LC-ESI-ITFT; MS2; CE: 90%; R=15000; [M+H]+
- Aloin A; LC-ESI-ITFT; MS2; CE: 75%; R=15000; [M+H]+
- Aloin A; LC-ESI-ITFT; MS2; CE: 90%; R=15000; [M+H]+
- Aloin A; LC-ESI-ITFT; MS2; CE: 110%; R=15000; [M+H]+
- Aloin A; LC-ESI-ITFT; MS2; CE: 55%; R=15000; [M+H]+
- Aloin A; LC-ESI-ITFT; MS2; CE: 125%; R=15000; [M+H]+
- Aloin A; LC-ESI-ITFT; MS2; CE: 85%; R=15000; [M+H]+
- Aloin A; LC-ESI-ITFT; MS2; CE: 35%; R=15000; [M+H]+
- Aloin A; LC-ESI-ITFT; MS2; CE: 125%; R=15000; [M+H]+
- Aloin A; LC-ESI-ITFT; MS2; CE: 55%; R=15000; [M+H]+
- Aloin A; LC-ESI-ITFT; MS2; CE: 80%; R=15000; [M+H]+
- Aloin A; LC-ESI-ITFT; MS2; CE: 25%; R=15000; [M+H]+
- Aloin A; LC-ESI-ITFT; MS2; CE: 125%; R=15000; [M+H]+
- Aloin A; LC-ESI-ITFT; MS2; CE: 30%; R=15000; [M+H]+
- Aloin A; LC-ESI-ITFT; MS2; CE: 65%; R=15000; [M+H]+
- Aloin A; LC-ESI-ITFT; MS2; CE: 90%; R=15000; [M+H]+
- Aloin A; LC-ESI-ITFT; MS2; CE: 20%; R=15000; [M+H]+
- Aloin A; LC-ESI-ITFT; MS2; CE: 25%; R=15000; [M+H]+
-
(10S)-10,20-dihydroxy-6,10,23-trimethyl-4-azahexacyclo[12.11.0.02,11.04,9.015... Molecule
InChIKey RBVQXLKYWVYWQU-RQQIEUDCSA-N Molecular Formula C27H45NO4
Related Dataset(s)
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(10S)-2-hydroxy-3-[(1R)-1-hydroxyheptyl]-10-[(S)-hydroxy-[(2S)-6-oxo-2,3-dihy... Molecule
InChIKey ZJTBTDVZNGBSNG-WTFOXLIOSA-N Molecular Formula C26H30O11
Related Dataset(s)
-
(10S,13R)-3,14-dihydroxy-13-methyl-17-(5-oxo-2H-furan-3-yl)-1,2,3,6,7,8,9,11,... Molecule
InChIKey JPIDFRQBAGAXJM-NGIHOKHASA-N Molecular Formula C23H30O5
Related Dataset(s)
- Hyrcanogenin; LC-ESI-QQQ; MS2; Frag=135.0V CID@5.0; [M+H]+
- Hyrcanogenin; LC-ESI-QQQ; MS2; Frag=135.0V CID@25.0; [M+HCOO]-
- Hyrcanogenin; LC-ESI-QQQ; MS2; Frag=135.0V CID@5.0; [M+HCOO]-
- Hyrcanogenin; LC-ESI-QQQ; MS2; Frag=135.0V CID@15.0; [M+HCOO]-
- Hyrcanogenin; LC-ESI-QQQ; MS2; Frag=135.0V CID@10.0; [M+H]+
- Hyrcanogenin; LC-ESI-QQQ; MS2; Frag=135.0V CID@25.0; [M+H]+
- Hyrcanogenin; LC-ESI-QQQ; MS2; Frag=135.0V CID@10.0; [M+HCOO]-
- Hyrcanogenin; LC-ESI-QQQ; MS2; Frag=135.0V CID@15.0; [M+H]+
-
(10S,13R)-3,5,14-trihydroxy-13-methyl-17-(5-oxo-2H-furan-3-yl)-2,3,4,6,7,8,9,... Molecule
InChIKey XJIILRFVONGQOG-BNUXJICCSA-N Molecular Formula C23H32O7
Related Dataset(s)
- Strophanthidinic acid; LC-ESI-QQQ; MS; [M+H]+
- Strophanthidinic acid; LC-ESI-QQQ; MS2; Frag=135.0V CID@15.0; [M+H]+
- Strophanthidinic acid; LC-ESI-QQQ; MS2; Frag=135.0V CID@5.0; [M+H]+
- Strophanthidinic acid; LC-ESI-QQQ; MS2; Frag=135.0V CID@10.0; [M+H]+
- Strophanthidinic acid; LC-ESI-QQQ; MS2; Frag=135.0V CID@25.0; [M+H]+
-
(10S,13R)-5,14-dihydroxy-3-[(2R,4S,6R)-4-hydroxy-6-methyl-5-[(3R,4S,5S,6R)-3,... Molecule
InChIKey KQBVSIZPUWODNU-TWBSMWMUSA-N Molecular Formula C35H52O14
Related Dataset(s)
- Olitoriside; LC-ESI-QQQ; MS2; Frag=135.0V CID@10.0; [M+HCOO]-
- Olitoriside; LC-ESI-QQQ; MS2; Frag=135.0V CID@25.0; [M+H]+
- Olitoriside; LC-ESI-QQQ; MS2; Frag=135.0V CID@15.0; [M+HCOO]-
- Olitoriside; LC-ESI-QQQ; MS2; Frag=135.0V CID@5.0; [M+HCOO]-
- Olitoriside; LC-ESI-QQQ; MS2; Frag=135.0V CID@15.0; [M+H]+
- Olitoriside; LC-ESI-QQQ; MS2; Frag=135.0V CID@10.0; [M+H]+
- Olitoriside; LC-ESI-QQQ; MS2; Frag=135.0V CID@25.0; [M+HCOO]-
- Olitoriside; LC-ESI-QQQ; MS2; Frag=135.0V CID@5.0; [M+H]+
-
(10S,13R,17S)-3,5,14,16-tetrahydroxy-13-methyl-17-(5-oxo-2H-furan-3-yl)-2,3,4... Molecule
InChIKey LKRKDJSHACERQF-NBJYSJMPSA-N Molecular Formula C23H32O7
Related Dataset(s)
- 17alpha-Strophadogenin; LC-ESI-QQQ; MS2; Frag=135.0V CID@5.0; [M+H]+
- 17alpha-Strophadogenin; LC-ESI-QQQ; MS2; Frag=135.0V CID@15.0; [M+H]+
- 17alpha-Strophadogenin; LC-ESI-QQQ; MS2; Frag=135.0V CID@5.0; [M+HCOO]-
- 17alpha-Strophadogenin; LC-ESI-QQQ; MS2; Frag=135.0V CID@25.0; [M+HCOO]-
- 17alpha-Strophadogenin; LC-ESI-QQQ; MS2; Frag=135.0V CID@25.0; [M+H]+
- 17alpha-Strophadogenin; LC-ESI-QQQ; MS2; Frag=135.0V CID@10.0; [M+H]+
- 17alpha-Strophadogenin; LC-ESI-QQQ; MS2; Frag=135.0V CID@15.0; [M+HCOO]-
- 17alpha-Strophadogenin; LC-ESI-QQQ; MS2; Frag=135.0V CID@10.0; [M+HCOO]-
-
(10a-methoxy-4,7-dimethyl-6a,8,9,10-tetrahydro-6H-indolo[4,3-fg]quinolin-9-yl... Molecule
InChIKey YSEXMKHXIOCEJA-UHFFFAOYSA-N Molecular Formula C24H26BrN3O3
Related Dataset(s)
-
(10aR,12aS)-10a,12a-dimethyl-4,4a,4b,5,6,10b,11,12-octahydro-3H-naphtho[2,1-f... Molecule
InChIKey BPEWUONYVDABNZ-WFZCBACDSA-N Molecular Formula C19H24O3
Related Dataset(s)
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(11-acetyloxy-10-hydroxy-1,5-dimethylspiro[8-oxatricyclo[7.2.1.02,7]dodec-5-e... Molecule
InChIKey AUGQEEXBDZWUJY-UHFFFAOYSA-N Molecular Formula C19H26O7
Related Dataset(s)
- Diacetoxyscirpenol; LC-ESI-ITFT; MS2; CE: 60%; R=7500; [M+H]+
- Diacetoxyscirpenol; LC-ESI-ITFT; MS2; CE: 15%; R=7500; [M+H]+
- Diacetoxyscirpenol; LC-ESI-ITFT; MS2; CE: 50%; R=7500; [M+H]+
- Diacetoxyscirpenol; LC-ESI-ITFT; MS2; CE: 40%; R=7500; [M+H]+
- Diacetoxyscirpenol; LC-ESI-ITFT; MS2; CE: 20%; R=7500; [M+H]+
-
(11-ethyl-3,8-dihydroxy-4,6,16-trimethoxy-11-azahexacyclo[7.7.2.12,5.01,10.03... Molecule
InChIKey VSUODASNSRJNCP-UHFFFAOYSA-N Molecular Formula C30H42N2O7
Related Dataset(s)
-
(11-ethyl-8,9-dihydroxy-4,6,16,18-tetramethoxy-11-azahexacyclo[7.7.2.12,5.01,... Molecule
InChIKey XLTANAWLDBYGFU-UHFFFAOYSA-N Molecular Formula C37H50N2O10
Related Dataset(s)
- Methyllycaconitine; LC-ESI-QTOF; MS; POSITIVE
- Methyllycaconitine; LC-ESI-QTOF; MS2; CE 40 ev; [M+H]+
- Methyllycaconitine; LC-ESI-QTOF; MS2; CE 20 ev; [M+H]+
- Methyllycaconitine; LC-ESI-QTOF; MS; NEGATIVE
- Methyllycaconitine; LC-ESI-QTOF; MS2; CE 10 ev; [M+H]+
- Methyllycaconitine; LC-APCI-QTOF; MS; POSITIVE
- Methyllycaconitine; LC-APCI-QTOF; MS; NEGATIVE
-
(11-ethyl-8,9-dihydroxy-4,6,16,18-tetramethoxy-11-azahexacyclo[7.7.2.12,5.01,... Molecule
InChIKey NNDHDYDFEDRMGH-UHFFFAOYSA-N Molecular Formula C32H46N2O8
Related Dataset(s)
-
(11R,15R,17R)-4-hydroxy-17-methyl-12,16-dioxatetracyclo[8.7.0.03,8.011,15]hep... Molecule
InChIKey XUWPJKDMEZSVTP-LTYMHZPRSA-N Molecular Formula C16H12O6
Related Dataset(s)
-
(11S,12E)-12-ethylidene-8,14-diazapentacyclo[9.5.2.01,9.02,7.014,17]octadeca-... Molecule
InChIKey VFUITWPFKLGEQA-IJEMKVKBSA-N Molecular Formula C19H20N2O
Related Dataset(s)
- Nor-C-fluorocurarine; LC-ESI-QQQ; MS2; Frag=135.0V CID@10.0; [M+H]+
- Nor-C-fluorocurarine; LC-ESI-QQQ; MS; [M+H]+
- Nor-C-fluorocurarine; LC-ESI-QQQ; MS2; Frag=135.0V CID@25.0; [M+H]+
- Nor-C-fluorocurarine; LC-ESI-QQQ; MS2; Frag=135.0V CID@15.0; [M+H]+
- Nor-C-fluorocurarine; LC-ESI-QQQ; MS2; Frag=135.0V CID@5.0; [M+H]+
-
(11S,12E,17S)-12-ethylidene-6-hydroxy-8,14-diazapentacyclo[9.5.2.01,9.02,7.01... Molecule
InChIKey JDOFCMASVRMYJU-PCKYSSEZSA-N Molecular Formula C19H20N2O2
Related Dataset(s)
-
(11Z,14Z)-icosa-11,14-dienoic acid Molecule
InChIKey XSXIVVZCUAHUJO-HZJYTTRNSA-N Molecular Formula C20H36O2
Related Dataset(s)
