|
> Lignans, neolignans and related compounds
|
|
(1S,14S)-20,21,25-trimethoxy-15,30-dimethyl-7,23-dioxa-15,30-diazaheptacyclo[22.6.2.23,6.18,12.114,18.027,31.022,33]hexatriaconta-3(36),4,6(35),8,10,12(34),18,20,22(33),24,26,31-dodecaen-9-ol
|
6330552 |
Click to see
|
608.70 |
unknown |
https://doi.org/10.1248/CPB.33.3658 |
|
> Lipids and lipid-like molecules / Fatty Acyls / Fatty acids and conjugates / Long-chain fatty acids
|
|
Oleic Acid
|
445639 |
Click to see
|
282.50 |
unknown |
via CMAUP database |
|
> Lipids and lipid-like molecules / Fatty Acyls / Lineolic acids and derivatives
|
|
Methyl linoleate
|
5284421 |
Click to see
|
294.50 |
unknown |
via CMAUP database |
|
> Lipids and lipid-like molecules / Glycerolipids / Triradylcglycerols / Triacylglycerols
|
|
Trilaurin
|
10851 |
Click to see
CCCCCCCCCCCC(=O)OCC(COC(=O)CCCCCCCCCCC)OC(=O)CCCCCCCCCCC
|
639.00 |
unknown |
via CMAUP database |
|
> Lipids and lipid-like molecules / Prenol lipids / Diterpenoids / Aconitane-type diterpenoid alkaloids
|
|
(1a,3a,6a,14a,15a,16b)-1,6,16-Trimethoxy-4-(methoxymethyl)-20-methyl-aconitane-3,8,13,14,15-pentol 8-acetate 14-benzoate
|
145994469 |
Click to see
|
631.70 |
unknown |
https://doi.org/10.1248/CPB.31.2884 https://doi.org/10.1248/CPB.35.2615 |
|
(1S,2R,3R,4S,5S,6S,8R,9R,10R,13S,16S,17R,18S)-11-ethyl-6-methoxy-13-(methoxymethyl)-11-azahexacyclo[7.7.2.12,5.01,10.03,8.013,17]nonadecane-4,8,16,18-tetrol
|
100930481 |
Click to see
|
423.50 |
unknown |
https://doi.org/10.1248/CPB.35.2615 |
|
(1S,2R,3R,4S,5S,6S,8R,9R,10S,13S,16S,17R)-11-ethyl-6-methoxy-13-(methoxymethyl)-11-azahexacyclo[7.7.2.12,5.01,10.03,8.013,17]nonadecane-4,8,9,16-tetrol
|
100964235 |
Click to see
|
423.50 |
unknown |
https://doi.org/10.1248/CPB.35.2615 |
|
(1S,2R,3R,4S,5S,6S,8S,13R,16S,17R)-11-ethyl-6-methoxy-13-methyl-11-azahexacyclo[7.7.2.12,5.01,10.03,8.013,17]nonadecane-4,8,16-triol
|
137706265 |
Click to see
|
377.50 |
unknown |
https://doi.org/10.1248/CPB.33.3658 |
|
(1S,2S,3S,4S,5R,6R,8S,9R,10R,13S,16S,17R,18R)-11-ethyl-6,18-dimethoxy-13-(methoxymethyl)-11-azahexacyclo[7.7.2.12,5.01,10.03,8.013,17]nonadecane-4,8,16-triol
|
162955783 |
Click to see
|
437.60 |
unknown |
https://doi.org/10.1248/CPB.33.3658 |
|
[(1S,2R,3R,4R,5R,6S,7S,8R,9R,13R,14R,16S,17S,18R)-8-acetyloxy-11-ethyl-5,7,14-trihydroxy-6,16,18-trimethoxy-13-(methoxymethyl)-11-azahexacyclo[7.7.2.12,5.01,10.03,8.013,17]nonadecan-4-yl] 4-methoxybenzoate
|
441741 |
Click to see
|
675.80 |
unknown |
https://doi.org/10.1248/CPB.35.2615 https://doi.org/10.1248/CPB.31.2884 https://doi.org/10.1248/CPB.33.3658 |
|
[(1S,2R,3R,4R,5R,6S,8R,9S,10S,13S,16R,17R,18R)-11-ethyl-8,9,16-trihydroxy-6,18-dimethoxy-13-(methoxymethyl)-11-azahexacyclo[7.7.2.12,5.01,10.03,8.013,17]nonadecan-4-yl] acetate
|
162908854 |
Click to see
|
495.60 |
unknown |
https://doi.org/10.1248/CPB.33.3658 |
|
[(1S,2R,3R,4R,5S,6S,7S,8R,9R,13R,16S,17S,18R)-8-acetyloxy-11-ethyl-5,7,14-trihydroxy-6,16,18-trimethoxy-13-(methoxymethyl)-11-azahexacyclo[7.7.2.12,5.01,10.03,8.013,17]nonadecan-4-yl] benzoate
|
139593379 |
Click to see
|
645.70 |
unknown |
https://doi.org/10.1248/CPB.33.3658 https://doi.org/10.1248/CPB.31.2884 |
|
[(2S,3S,5R,8R,13S,17S)-8-acetyloxy-5,7-dihydroxy-6,16,18-trimethoxy-13-(methoxymethyl)-11-methyl-11-azahexacyclo[7.7.2.12,5.01,10.03,8.013,17]nonadecan-4-yl] benzoate
|
138115321 |
Click to see
CC(=O)OC12C3C(CC(C3OC(=O)C4=CC=CC=C4)(C(C1O)OC)O)C56C(CCC7(C5C(C2C6N(C7)C)OC)COC)OC
|
615.70 |
unknown |
https://doi.org/10.1248/CPB.33.3658 https://doi.org/10.1248/CPB.31.2884 |
|
[11-Ethyl-5,7,14-trihydroxy-6,8,16,18-tetramethoxy-13-(methoxymethyl)-11-azahexacyclo[7.7.2.12,5.01,10.03,8.013,17]nonadecan-4-yl] 4-methoxybenzoate
|
73813224 |
Click to see
|
647.80 |
unknown |
https://doi.org/10.1248/CPB.33.4717 |
|
3-Deoxyaconitine
|
78358503 |
Click to see
CCN1CC2(CCC(C34C2C(C(C31)C5(C6C4CC(C6OC(=O)C7=CC=CC=C7)(C(C5O)OC)O)OC(=O)C)OC)OC)COC
|
629.70 |
unknown |
https://doi.org/10.1248/CPB.31.2884 https://doi.org/10.1248/CPB.33.3658 |
|
Aconitine
|
245005 |
Click to see
|
645.70 |
unknown |
https://doi.org/10.1248/CPB.33.3658 https://doi.org/10.1248/CPB.31.2884 |
|
Bullatine B
|
120682 |
Click to see
|
437.60 |
unknown |
https://doi.org/10.1248/CPB.33.3658 https://doi.org/10.1248/CPB.35.2615 |
|
Bullatine B
|
146014456 |
Click to see
|
437.60 |
unknown |
https://doi.org/10.1248/CPB.33.3658 https://doi.org/10.1248/CPB.35.2615 |
|
Carmicheline
|
441742 |
Click to see
CCN1CC2(CCC(C34C2CC(C31)C5(CC(C6CC4C5C6O)OC)O)O)C
|
377.50 |
unknown |
https://doi.org/10.1248/CPB.33.3658 |
|
CID 165283
|
165283 |
Click to see
CCN1CC2(CCC(C34C2C(C(C31)C5(CC(C6CC4C5C6O)OC)O)OC)OC)COC
|
451.60 |
unknown |
via CMAUP database |
|
Dehydrobrowniine
|
165269 |
Click to see
|
465.60 |
unknown |
https://doi.org/10.1248/CPB.35.2615 |
|
Delcosine 14-acetate
|
137332012 |
Click to see
|
495.60 |
unknown |
https://doi.org/10.1248/CPB.33.3658 |
|
Hypaconitine
|
441737 |
Click to see
CC(=O)OC12C3C(CC(C3OC(=O)C4=CC=CC=C4)(C(C1O)OC)O)C56C(CCC7(C5C(C2C6N(C7)C)OC)COC)OC
|
615.70 |
unknown |
https://doi.org/10.1248/CPB.31.2884 https://doi.org/10.1248/CPB.33.3658 |
|
Isotalatisidine
|
12304578 |
Click to see
|
407.50 |
unknown |
https://doi.org/10.1248/CPB.35.2615 |
|
N-desethyl-N-methylaconitine
|
441747 |
Click to see
|
631.70 |
unknown |
https://doi.org/10.1248/CPB.35.2615 https://doi.org/10.1248/CPB.31.2884 |
|
SureCN4184478
|
118701203 |
Click to see
|
675.80 |
unknown |
https://doi.org/10.1248/CPB.31.2884 https://doi.org/10.1248/CPB.35.2615 https://doi.org/10.1248/CPB.33.3658 |
|
> Lipids and lipid-like molecules / Prenol lipids / Diterpenoids / Villanovane, atisane, trachylobane or helvifulvane diterpenoids / Atisane diterpenoids / Hetisine-type diterpenoid alkaloids
|
|
[(1R,3R,4R,5S,8R,9S,11S,13R,14S,16S,17R,18R)-4,13,18-trihydroxy-5-methyl-12-methylidene-7-azaheptacyclo[9.6.2.01,8.05,17.07,16.09,14.014,18]nonadecan-3-yl] benzoate
|
101603143 |
Click to see
|
449.50 |
unknown |
https://doi.org/10.1248/CPB.33.3658 |
|
Ignavine
|
3035320 |
Click to see
CC12CN3C4C1C5(C3C6CC7CC5(C6(C4)C(C7=C)O)O)CC(C2O)OC(=O)C8=CC=CC=C8
|
449.50 |
unknown |
https://doi.org/10.1248/CPB.33.3658 |
|
> Lipids and lipid-like molecules / Prenol lipids / Monoterpenoids / Acyclic monoterpenoids
|
|
cis-alpha-Ocimene
|
5463455 |
Click to see
|
136.23 |
unknown |
via CMAUP database |
|
> Lipids and lipid-like molecules / Prenol lipids / Sesquiterpenoids
|
|
Caryophyllene
|
5281515 |
Click to see
CC1=CCCC(=C)C2CC(C2CC1)(C)C
|
204.35 |
unknown |
via CMAUP database |
|
> Lipids and lipid-like molecules / Prenol lipids / Sesquiterpenoids / Elemane sesquiterpenoids
|
|
Beta-Elemene
|
6918391 |
Click to see
|
204.35 |
unknown |
via CMAUP database |
|
> Lipids and lipid-like molecules / Prenol lipids / Sesquiterpenoids / Eremophilane, 8,9-secoeremophilane and furoeremophilane sesquiterpenoids
|
|
1,2,3,4,6,7,8,8a-Octahydro-alpha,alpha,8,8a-tetramethyl-2-naphthalenemethanol
|
146808 |
Click to see
|
222.37 |
unknown |
via CMAUP database |
|
> Lipids and lipid-like molecules / Prenol lipids / Triterpenoids
|
|
Lupeol
|
259846 |
Click to see
CC(=C)C1CCC2(C1C3CCC4C5(CCC(C(C5CCC4(C3(CC2)C)C)(C)C)O)C)C
|
426.70 |
unknown |
via CMAUP database |
|
Parkeol
|
12313974 |
Click to see
CC(CCC=C(C)C)C1CCC2(C1(CC=C3C2CCC4C3(CCC(C4(C)C)O)C)C)C
|
426.70 |
unknown |
via CMAUP database |
|
> Lipids and lipid-like molecules / Steroids and steroid derivatives / Cycloartanols and derivatives
|
|
(1S,3R,6S,8R,11S,12S,15R,16R)-15-[(2R,5S)-5-ethyl-6-methylhept-6-en-2-yl]-7,7,12,16-tetramethylpentacyclo[9.7.0.01,3.03,8.012,16]octadecan-6-ol
|
44423569 |
Click to see
CCC(CCC(C)C1CCC2(C1(CCC34C2CCC5C3(C4)CCC(C5(C)C)O)C)C)C(=C)C
|
454.80 |
unknown |
via CMAUP database |
|
Cycloneolitsol
|
101306728 |
Click to see
CC(CCC(C)(C)C(=C)C)C1CCC2(C1(CCC34C2CCC5C3(C4)CCC(C5(C)C)O)C)C
|
454.80 |
unknown |
via CMAUP database |
|
> Lipids and lipid-like molecules / Steroids and steroid derivatives / Ergostane steroids / Ergosterols and derivatives
|
|
(3beta)-24-Methylenelanost-9(11)-en-3-ol
|
489917 |
Click to see
|
440.70 |
unknown |
via CMAUP database |
|
(3S,5R,8S,10S,13R,14S,17R)-17-[(2R,5S)-5,6-dimethylhept-6-en-2-yl]-4,4,10,13,14-pentamethyl-2,3,5,6,7,8,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-3-ol
|
101630502 |
Click to see
|
440.70 |
unknown |
via CMAUP database |
|
24,24-Dimethyllanosta-9(11),25-dien-3beta-ol
|
102504569 |
Click to see
CC(CCC(C)(C)C(=C)C)C1CCC2(C1(CC=C3C2CCC4C3(CCC(C4(C)C)O)C)C)C
|
454.80 |
unknown |
via CMAUP database |
|
4alpha,14alpha-Dimethyl-24-methylene-cholest-9(11)-en-3beta-ol
|
5283648 |
Click to see
CC1C2CCC3C(=CCC4(C3(CCC4C(C)CCC(=C)C(C)C)C)C)C2(CCC1O)C
|
426.70 |
unknown |
via CMAUP database |
|
> Lipids and lipid-like molecules / Steroids and steroid derivatives / Stigmastanes and derivatives
|
|
(-)-beta-Sitosterol
|
222284 |
Click to see
|
414.70 |
unknown |
via CMAUP database |
|
(3S,4S,5S,8S,10S,13R,14S,17R)-17-[(2R,5R)-5-ethyl-6-methylheptan-2-yl]-4,10,13,14-tetramethyl-1,2,3,4,5,6,7,8,12,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-ol
|
101630496 |
Click to see
|
442.80 |
unknown |
via CMAUP database |
|
(3S,4S,5S,8S,10S,13R,14S,17R)-17-[(2R,5S)-5-ethyl-6-methylhept-6-en-2-yl]-4,10,13,14-tetramethyl-1,2,3,4,5,6,7,8,12,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-ol
|
101630497 |
Click to see
CCC(CCC(C)C1CCC2(C1(CC=C3C2CCC4C3(CCC(C4C)O)C)C)C)C(=C)C
|
440.70 |
unknown |
via CMAUP database |
|
(3S,5R,8S,10S,13R,14S,17R)-17-[(2R,5S)-5-ethyl-6-methylhept-6-en-2-yl]-4,4,10,13,14-pentamethyl-2,3,5,6,7,8,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-3-ol
|
101630504 |
Click to see
|
454.80 |
unknown |
via CMAUP database |
|
Citrostadienol
|
9548595 |
Click to see
|
426.70 |
unknown |
via CMAUP database |
|
Sitogluside
|
5742590 |
Click to see
CCC(CCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)OC5C(C(C(C(O5)CO)O)O)O)C)C)C(C)C
|
576.80 |
unknown |
via CMAUP database |
|
Stigmast-4-en-3-one
|
5484202 |
Click to see
CCC(CCC(C)C1CCC2C1(CCC3C2CCC4=CC(=O)CCC34C)C)C(C)C
|
412.70 |
unknown |
via CMAUP database |
|
> Organoheterocyclic compounds / Dihydrofurans / Furanones / Butenolides
|
|
5H-7,4-Methenofuro(3,2-c)oxireno(f)oxacycloundecin-5-one,1a,2,3,7,11,11a-hexahydro-8,11a-dimethyl-, (1aS,7R,11aS)-
|
497202 |
Click to see
CC1=COC2=C1C3C=C(CCC4C(C2)(O4)C)C(=O)O3
|
260.28 |
unknown |
via CMAUP database |
|
Linderalactone
|
6450191 |
Click to see
|
244.28 |
unknown |
via CMAUP database |
|
Pseudoneolinderane
|
57400551 |
Click to see
|
260.28 |
unknown |
via CMAUP database |
|
Zeylanin
|
12445041 |
Click to see
CC1=CC2=C(C3C=C(CCC1OC(=O)C)C(=O)O3)C(=CO2)C
|
302.32 |
unknown |
via CMAUP database |
|
> Organoheterocyclic compounds / Dioxanes / 1,4-dioxanes
|
|
2H-10,1a-(Epoxymethano)oxireno(4,5)cyclodeca(1,2-b)furan-12-one, 3,6,10,10a-tetrahydro-5,9-methyl-, (1aS-(1aR*,4E,10R*,10aR*))-
|
6450227 |
Click to see
|
260.28 |
unknown |
via CMAUP database |
|
> Phenylpropanoids and polyketides / Flavonoids / Flavans / Catechins
|
|
Catechin
|
9064 |
Click to see
|
290.27 |
unknown |
via CMAUP database |
|
> Phenylpropanoids and polyketides / Flavonoids / Flavans / Flavanones / Flavanonols
|
|
(2R,3S)-2-(3,4-Dihydroxyphenyl)-3,5,7-Trihydroxy-2,3-Dihydrochromen-4-One
|
712318 |
Click to see
|
304.25 |
unknown |
via CMAUP database |
|
> Phenylpropanoids and polyketides / Flavonoids / Flavonoid glycosides / Flavonoid O-glycosides
|
|
5-hydroxy-3,6,7-trimethoxy-2-[4-[(2S,5S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]chromen-4-one
|
44259755 |
Click to see
|
506.50 |
unknown |
https://doi.org/10.1248/CPB.33.3658 |
|
> Phenylpropanoids and polyketides / Flavonoids / Flavonoid glycosides / Flavonoid O-glycosides / Flavonoid-7-O-glycosides
|
|
kaempferol 3-O-rhamnoside-7-O-glucoside
|
90795788 |
Click to see
|
594.50 |
unknown |
via CMAUP database |