> Benzenoids / Benzene and substituted derivatives / Toluenes
|
1-methyl-4-[(1R)-1,2,3-trimethylcyclopent-2-en-1-yl]benzene
|
11790229 |
Click to see
CC1=C(C(CC1)(C)C2=CC=C(C=C2)C)C
|
200.32 |
unknown |
via CMAUP database |
> Benzenoids / Naphthalenes / Naphthalenecarboxylic acids and derivatives / Naphthalenecarboxylic acids
|
6-[3-[(5-Carboxy-4-methyl-7,8-dihydronaphthalen-2-yl)oxy]but-2-en-2-yloxy]-8-methyl-3,4-dihydronaphthalene-1-carboxylic acid
|
162877658 |
Click to see
CC1=CC(=CC2=C1C(=CCC2)C(=O)O)OC(=C(C)OC3=CC4=C(C(=C3)C)C(=CCC4)C(=O)O)C
|
460.50 |
unknown |
https://doi.org/10.1002/CBDV.200800128 |
> Benzenoids / Phenols / Cresols / Meta cresols
|
2-[(1R,2R,3R)-1,2,3-Trimethyl-3-hydroxycyclopentyl]-5-methylphenol
|
11608348 |
Click to see
CC1C(CCC1(C)O)(C)C2=C(C=C(C=C2)C)O
|
234.33 |
unknown |
via CMAUP database |
2-[(1R,2R)-1,2-Dimethyl-3-(bromomethylene)cyclopentyl]-5-methylphenol
|
12305606 |
Click to see
CC1C(=CBr)CCC1(C)C2=C(C=C(C=C2)C)O
|
295.21 |
unknown |
via CMAUP database |
4-Bromo-2-[(1R,2S)-1,2-dimethyl-3-methylenecyclopentyl]-5-methylphenol
|
470278 |
Click to see
CC1C(=C)CCC1(C)C2=C(C=C(C(=C2)Br)C)O
|
295.21 |
unknown |
via CMAUP database |
Phenol, 2-[(1R,2S)-1,2-dimethyl-3-methylenecyclopentyl]-5-methyl-
|
11096028 |
Click to see
CC1C(=C)CCC1(C)C2=C(C=C(C=C2)C)O
|
216.32 |
unknown |
via CMAUP database |
> Hydrocarbons / Saturated hydrocarbons / Alkanes
|
Heptadecane
|
12398 |
Click to see
CCCCCCCCCCCCCCCCC
|
240.50 |
unknown |
via CMAUP database |
> Lipids and lipid-like molecules / Fatty Acyls / Fatty acids and conjugates / Long-chain fatty acids
|
Palmitic Acid
|
985 |
Click to see
CCCCCCCCCCCCCCCC(=O)O
|
256.42 |
unknown |
via CMAUP database |
> Lipids and lipid-like molecules / Fatty Acyls / Fatty acids and conjugates / Very long-chain fatty acids
|
Hexacosanoic acid
|
10469 |
Click to see
CCCCCCCCCCCCCCCCCCCCCCCCCC(=O)O
|
396.70 |
unknown |
https://doi.org/10.1002/CBDV.200800128 |
> Lipids and lipid-like molecules / Fatty Acyls / Fatty alcohols
|
(3E,6R,7S,9Z,12E)-pentadeca-3,9,12-trien-1-yne-6,7-diol
|
23424687 |
Click to see
CCC=CCC=CCC(C(CC=CC#C)O)O
|
234.33 |
unknown |
via CMAUP database |
(3Z,6R,7S,9Z,12E)-pentadeca-3,9,12-trien-1-yne-6,7-diol
|
23424689 |
Click to see
CCC=CCC=CCC(C(CC=CC#C)O)O
|
234.33 |
unknown |
via CMAUP database |
> Lipids and lipid-like molecules / Fatty Acyls / Fatty aldehydes
|
(E)-2-Tridecyl-2-heptadecenal
|
11122959 |
Click to see
CCCCCCCCCCCCCCC=C(CCCCCCCCCCCCC)C=O
|
434.80 |
unknown |
via CMAUP database |
> Lipids and lipid-like molecules / Prenol lipids / Diterpenoids
|
(1aR,betaR)-3beta,9beta-Dihydroxy-1abeta,5,7bbeta-trimethyl-1a,1balpha,2,3,3abeta,4,5,6,7b,8,9,9abeta-dodecahydro-beta-bromo-1H-cyclopropa[a]phenanthrene-5beta-ethanol
|
21773110 |
Click to see
CC1(CC=C2C(C1)C(CC3C2(CC(C4C3(C4)C)O)C)O)C(CO)Br
|
399.40 |
unknown |
via CMAUP database |
(1aS,betaR)-1abeta-Acetyloxymethyl-3beta-hydroxy-5,7bbeta-dimethyl-9beta-acetyloxy-1a,1balpha,2,3,3abeta,4,5,6,7b,8,9,9abeta-dodecahydro-beta-bromo-1H-cyclopropa[a]phenanthrene-5beta-ethanol 5-acetate
|
14891049 |
Click to see
CC(=O)OCC(C1(CC=C2C(C1)C(CC3C2(CC(C4C3(C4)COC(=O)C)OC(=O)C)C)O)C)Br
|
541.50 |
unknown |
via CMAUP database |
2-Deacetoxydeoxyparguerol
|
14891056 |
Click to see
CC12CCC3CC3(C1CC(C4C2=CCC(C4)(C)C(CO)Br)O)C
|
383.40 |
unknown |
via CMAUP database |
9H-cyclopropa[a]phenanthren-9-one, 5-[(1R)-1-bromo-2-hydroxyethyl]-1,1a,1b,2,3,3a,4,5,6,7b,8,9a-dodecahydro-3-hydroxy-1a-(hydroxymethyl)-5,7b-dimethyl-, (1aS,1bS,3R,3aR,5S,7bR,9aR)-
|
639613 |
Click to see
CC1(CC=C2C(C1)C(CC3C2(CC(=O)C4C3(C4)CO)C)O)C(CO)Br
|
413.30 |
unknown |
via CMAUP database |
Deoxyparguerol
|
73628 |
Click to see
CC(=O)OC1CC2(C(CC(C3C2=CCC(C3)(C)C(CO)Br)O)C4(C1C4)C)C
|
441.40 |
unknown |
via CMAUP database |
Parguerol triacetate
|
14891040 |
Click to see
CC(=O)OCC(C1(CC=C2C(C1)C(CC3C2(CC(C4C3(C4)COC(=O)C)OC(=O)C)C)OC(=O)C)C)Br
|
583.50 |
unknown |
via CMAUP database |
> Lipids and lipid-like molecules / Prenol lipids / Diterpenoids / Tanshinones, isotanshinones, and derivatives
|
(3S,betaR)-10alpha-Acetyloxy-beta-bromo-3,4,4aalpha,5,6,6abeta,7,8,9,10,11,11a-dodecahydro-5alpha-hydroxy-3,11aalpha-dimethyl-7-methylene-9beta-[(1-oxohexadecyl)oxy]-2H-cyclohepta[a]naphthalene-3alpha-ethanol
|
21773166 |
Click to see
CCCCCCCCCCCCCCCC(=O)OC1CC(=C)C2CC(C3CC(CC=C3C2(CC1OC(=O)C)C)(C)C(CO)Br)O
|
695.80 |
unknown |
via CMAUP database |
> Lipids and lipid-like molecules / Prenol lipids / Monoterpenoids / Bicyclic monoterpenoids
|
(1S,3S,5S)-1-Isopropyl-4-methylenebicyclo[3.1.0]hexan-3-yl acetate
|
91699466 |
Click to see
CC(C)C12CC1C(=C)C(C2)OC(=O)C
|
194.27 |
unknown |
https://doi.org/10.1002/CBDV.200800128 |
> Lipids and lipid-like molecules / Prenol lipids / Sesquiterpenoids
|
(1R,2R,4R)-4-bromo-2-[2-[(2S,3R,6S)-3-bromo-6-[(1S)-2-chloro-1-hydroxyethyl]-2,6-dimethyloxan-2-yl]ethyl]-1,3,3-trimethylcyclohexan-1-ol
|
23425507 |
Click to see
CC1(C(CCC(C1CCC2(C(CCC(O2)(C)C(CCl)O)Br)C)(C)O)Br)C
|
518.70 |
unknown |
via CMAUP database |
(1S,2R,4R)-2-bromo-1-methyl-4-[3-[(1R,2R,3S,6S)-6-methyl-3-prop-1-en-2-yl-7-oxabicyclo[4.1.0]heptan-2-yl]prop-1-en-2-yl]cyclohexan-1-ol
|
10786187 |
Click to see
CC(=C)C1CCC2(C(C1CC(=C)C3CCC(C(C3)Br)(C)O)O2)C
|
383.40 |
unknown |
via CMAUP database |
(1S,2R,4R)-2-bromo-1-methyl-4-[3-[(1S,2R,3S,5S)-5-methyl-3-prop-1-en-2-yl-6-oxabicyclo[3.1.1]heptan-2-yl]prop-1-en-2-yl]cyclohexan-1-ol
|
10547984 |
Click to see
CC(=C)C1CC2(CC(C1CC(=C)C3CCC(C(C3)Br)(C)O)O2)C
|
383.40 |
unknown |
via CMAUP database |
(1S,2R,4R)-2-bromo-4-[(2E,4E)-5-[(2S,5R)-5-bromo-2,6,6-trimethyloxan-2-yl]penta-2,4-dien-2-yl]-1-methylcyclohexan-1-ol
|
60199643 |
Click to see
CC(=CC=CC1(CCC(C(O1)(C)C)Br)C)C2CCC(C(C2)Br)(C)O
|
464.30 |
unknown |
via CMAUP database |
(1S,2S,3R,4S)-3-[2-[(1R,3R,4S)-3-bromo-4-hydroxy-4-methylcyclohexyl]prop-2-enyl]-1-methyl-4-prop-1-en-2-ylcyclohexane-1,2-diol
|
10949410 |
Click to see
CC(=C)C1CCC(C(C1CC(=C)C2CCC(C(C2)Br)(C)O)O)(C)O
|
401.40 |
unknown |
via CMAUP database |
(3R)-2,3,4,5,6,7-Hexahydro-3,5,5-trimethyl-7-isopropyl-3beta,7beta-dihydroxy-1H-inden-1-one
|
14758697 |
Click to see
CC(C)C1(CC(CC2=C1C(=O)CC2(C)O)(C)C)O
|
252.35 |
unknown |
via CMAUP database |
1,6,6-Trimethyl-2beta-bromo-4beta-isopropyl-3aalpha,7aalpha-epoxyhydrindane-1alpha-ol
|
21632593 |
Click to see
CC(C)C1CC(CC23C1(O2)CC(C3(C)O)Br)(C)C
|
317.26 |
unknown |
via CMAUP database |
1,6,6-Trimethyl-2beta-chloro-4beta-isopropyl-3aalpha,7aalpha-epoxyhydrindane-1alpha-ol
|
21632591 |
Click to see
CC(C)C1CC(CC23C1(O2)CC(C3(C)O)Cl)(C)C
|
272.81 |
unknown |
via CMAUP database |
Brasilenol
|
14758694 |
Click to see
CC1CCC2=C1C(C(CC2C(C)C)(C)C)O
|
222.37 |
unknown |
via CMAUP database |
epi-Brasilenol
|
101324783 |
Click to see
CC1CCC2=C1C(C(CC2C(C)C)(C)C)O
|
222.37 |
unknown |
via CMAUP database |
Humulene
|
5281520 |
Click to see
CC1=CCC(C=CCC(=CCC1)C)(C)C
|
204.35 |
unknown |
via CMAUP database |
Neorogioldiol B
|
10906704 |
Click to see
CC1(C2CCC(C2C(C1C(=C)C3CCC(C(C3)Br)(C)O)Br)(C)O)C
|
464.30 |
unknown |
via CMAUP database |
Peurtitol A
|
3035892 |
Click to see
CC(=CC(CC(=C1CCC(C(C1)Br)(C)Cl)C)O)C
|
335.71 |
unknown |
via CMAUP database |
Peurtitol B
|
3035893 |
Click to see
CC(=CC(CC(=C1CCC(C(C1)Cl)(C)Br)C)O)C
|
335.71 |
unknown |
via CMAUP database |
Prevezol C
|
10046593 |
Click to see
CC(=C)C1CCC(C(C1CC(=C)C2CCC(C(C2)Br)(C)O)O)(C)O
|
401.40 |
unknown |
via CMAUP database |
> Lipids and lipid-like molecules / Prenol lipids / Sesquiterpenoids / Chamigranes
|
(3R,6S,9R,10R)-9-bromo-10-chloro-5,5,9-trimethyl-1-methylidenespiro[5.5]undecan-3-ol
|
23425287 |
Click to see
CC1(CC(CC(=C)C12CCC(C(C2)Cl)(C)Br)O)C
|
335.71 |
unknown |
via CMAUP database |
(3R,6S,9S,10S)-9-bromo-10-chloro-5,5,9-trimethyl-1-methylidenespiro[5.5]undecan-3-ol
|
23425290 |
Click to see
CC1(CC(CC(=C)C12CCC(C(C2)Cl)(C)Br)O)C
|
335.71 |
unknown |
via CMAUP database |
(3S,4R,6S)-4-bromo-5,5,9-trimethyl-1-methylidenespiro[5.5]undec-9-en-3-ol
|
23426376 |
Click to see
CC1=CCC2(CC1)C(=C)CC(C(C2(C)C)Br)O
|
299.25 |
unknown |
via CMAUP database |
(6R)-1,5,5,9-Tetramethylspiro[5.5]undeca-1,8-dien-3-one
|
14108777 |
Click to see
CC1=CCC2(CC1)C(=CC(=O)CC2(C)C)C
|
218.33 |
unknown |
via CMAUP database |
(6R)-10-chloro-1,5,5,9-tetramethylspiro[5.5]undeca-1,9-dien-3-one
|
14108776 |
Click to see
CC1=C(CC2(CC1)C(=CC(=O)CC2(C)C)C)Cl
|
252.78 |
unknown |
via CMAUP database |
(6R)-8beta-Bromo-9alpha-chloro-1,1,5,9-tetramethyl-2beta,5beta-epoxyspiro[5.5]undecane
|
636649 |
Click to see
CC1(C2CCC(C13CCC(C(C3)Br)(C)Cl)(O2)C)C
|
335.71 |
unknown |
via CMAUP database |
2,10-Diburomo-3-chloro-alpha-chamigrene
|
100955279 |
Click to see
CC1=CCC(C(C12CCC(C(C2)Br)(C)Cl)(C)C)Br
|
398.60 |
unknown |
via CMAUP database |
Debromoelastol
|
102233554 |
Click to see
CC1=C(CC2(CC1)C(=C)CC(CC2(C)C)O)Cl
|
254.79 |
unknown |
via CMAUP database |
Elatol
|
479931 |
Click to see
CC1=C(CC2(CC1)C(=C)CC(C(C2(C)C)Br)O)Cl
|
333.69 |
unknown |
via CMAUP database |
Isoobtusol
|
14108771 |
Click to see
CC1(C(C(CC(=C)C12CCC(C(C2)Cl)(C)Br)O)Br)C
|
414.60 |
unknown |
via CMAUP database |
Obtusane
|
14239683 |
Click to see
CC1(C(CCC(=C)C12CCC(C(C2)Cl)(C)Br)Br)C
|
398.60 |
unknown |
via CMAUP database |
Spiro(5.5)undecan-3-ol, 2,9-dibromo-8-chloro-1,1,9-trimethyl-5-methylene-, (2S,3R,6S,8S,9S)-
|
156000 |
Click to see
CC1(C(C(CC(=C)C12CCC(C(C2)Cl)(C)Br)O)Br)C
|
414.60 |
unknown |
via CMAUP database |
> Lipids and lipid-like molecules / Prenol lipids / Sesquiterpenoids / Eremophilane, 8,9-secoeremophilane and furoeremophilane sesquiterpenoids
|
(4S,4aS,5R,6S,8aR)-3,4a-dimethyl-4-(3-methylbutanoyloxy)-6-[(Z)-2-methylbut-2-enoyl]oxy-5,6,7,8,8a,9-hexahydro-4H-benzo[f][1]benzofuran-5-carboxylic acid
|
101596889 |
Click to see
CC=C(C)C(=O)OC1CCC2CC3=C(C(C2(C1C(=O)O)C)OC(=O)CC(C)C)C(=CO3)C
|
446.50 |
unknown |
https://doi.org/10.1246/BCSJ.78.1302 |
(4S,4aS,5R,6S,8aR)-3,4a-dimethyl-6-[(Z)-2-methylbut-2-enoyl]oxy-4-(3-methylbut-2-enoyloxy)-5,6,7,8,8a,9-hexahydro-4H-benzo[f][1]benzofuran-5-carboxylic acid
|
163191112 |
Click to see
CC=C(C)C(=O)OC1CCC2CC3=C(C(C2(C1C(=O)O)C)OC(=O)C=C(C)C)C(=CO3)C
|
444.50 |
unknown |
https://doi.org/10.1246/BCSJ.78.1302 |
(8-Chloro-3,4a,5-trimethyl-9-oxo-4,5,6,7,8,8a-hexahydrobenzo[f][1]benzofuran-4-yl) 2-methylpropanoate
|
163006331 |
Click to see
CC1CCC(C2C1(C(C3=C(C2=O)OC=C3C)OC(=O)C(C)C)C)Cl
|
352.80 |
unknown |
https://doi.org/10.1016/J.FITOTE.2008.02.012 |
(8,8a-dihydroxy-3,4a,5-trimethyl-9-oxo-5,6,7,8-tetrahydro-4H-benzo[f][1]benzofuran-4-yl) 2-methylbut-2-enoate
|
73810628 |
Click to see
CC=C(C)C(=O)OC1C2=C(C(=O)C3(C1(C(CCC3O)C)C)O)OC=C2C
|
362.40 |
unknown |
https://doi.org/10.1016/J.FITOTE.2008.02.012 https://doi.org/10.1002/CBDV.200800128 |
[(4S,4aR,5S,8S,8aR)-8-chloro-3,4a,5-trimethyl-9-oxo-4,5,6,7,8,8a-hexahydrobenzo[f][1]benzofuran-4-yl] 2-methylpropanoate
|
163006333 |
Click to see
CC1CCC(C2C1(C(C3=C(C2=O)OC=C3C)OC(=O)C(C)C)C)Cl
|
352.80 |
unknown |
https://doi.org/10.1016/J.FITOTE.2008.02.012 |
[(4S,4aR,5S,8S,8aS)-8-chloro-3,4a,5-trimethyl-9-oxo-4,5,6,7,8,8a-hexahydrobenzo[f][1]benzofuran-4-yl] 2-methylpropanoate
|
163006332 |
Click to see
CC1CCC(C2C1(C(C3=C(C2=O)OC=C3C)OC(=O)C(C)C)C)Cl
|
352.80 |
unknown |
https://doi.org/10.1016/J.FITOTE.2008.02.012 |
[(4S,4aS,5S,8S,8aR)-8-chloro-8a-hydroxy-3,4a,5-trimethyl-9-oxo-5,6,7,8-tetrahydro-4H-benzo[f][1]benzofuran-4-yl] 2-methylpropanoate
|
46944943 |
Click to see
CC1CCC(C2(C1(C(C3=C(C2=O)OC=C3C)OC(=O)C(C)C)C)O)Cl
|
368.80 |
unknown |
https://doi.org/10.1016/J.FITOTE.2008.02.012 https://doi.org/10.1002/CBDV.200800128 |
[(4S,4aS,5S,8S,8aR)-8,8a-dihydroxy-3,4a,5-trimethyl-9-oxo-5,6,7,8-tetrahydro-4H-benzo[f][1]benzofuran-4-yl] 2-methylpropanoate
|
162928384 |
Click to see
CC1CCC(C2(C1(C(C3=C(C2=O)OC=C3C)OC(=O)C(C)C)C)O)O
|
350.40 |
unknown |
https://doi.org/10.1002/CBDV.200800128 |
[(4S,4aS,5S,8S,8aS)-8,8a-dihydroxy-3,4a,5-trimethyl-9-oxo-5,6,7,8-tetrahydro-4H-benzo[f][1]benzofuran-4-yl] (Z)-2-methylbut-2-enoate
|
21595083 |
Click to see
CC=C(C)C(=O)OC1C2=C(C(=O)C3(C1(C(CCC3O)C)C)O)OC=C2C
|
362.40 |
unknown |
https://doi.org/10.1016/J.FITOTE.2008.02.012 https://doi.org/10.1002/CBDV.200800128 |
[(4S,4aS,5S,8S,8aS)-8,8a-dihydroxy-3,4a,5-trimethyl-9-oxo-5,6,7,8-tetrahydro-4H-benzo[f][1]benzofuran-4-yl] 2-methylpropanoate
|
162928382 |
Click to see
CC1CCC(C2(C1(C(C3=C(C2=O)OC=C3C)OC(=O)C(C)C)C)O)O
|
350.40 |
unknown |
https://doi.org/10.1002/CBDV.200800128 |
3,4a-dimethyl-4-(3-methylbutanoyloxy)-6-(2-methylbut-2-enoyloxy)-5,6,7,8,8a,9-hexahydro-4H-benzo[f][1]benzofuran-5-carboxylic acid
|
163000203 |
Click to see
CC=C(C)C(=O)OC1CCC2CC3=C(C(C2(C1C(=O)O)C)OC(=O)CC(C)C)C(=CO3)C
|
446.50 |
unknown |
https://doi.org/10.1246/BCSJ.78.1302 |
3,4a-dimethyl-6-(2-methylbut-2-enoyloxy)-4-(3-methylbut-2-enoyloxy)-5,6,7,8,8a,9-hexahydro-4H-benzo[f][1]benzofuran-5-carboxylic acid
|
163035343 |
Click to see
CC=C(C)C(=O)OC1CCC2CC3=C(C(C2(C1C(=O)O)C)OC(=O)C=C(C)C)C(=CO3)C
|
444.50 |
unknown |
https://doi.org/10.1246/BCSJ.78.1302 |
> Lipids and lipid-like molecules / Prenol lipids / Terpene glycosides / Triterpene glycosides / Triterpene saponins
|
(4aS,6aR,6aS,6bR,8aR,10S,12aR,14bS)-2,2,6a,6b,9,9,12a-heptamethyl-10-[(2R,3R,4S,5S,6S)-3,4,5-trihydroxy-6-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxycarbonyloxan-2-yl]oxy-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid
|
101603210 |
Click to see
CC1(CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(C5(C)C)OC6C(C(C(C(O6)C(=O)OC7C(C(C(C(O7)CO)O)O)O)O)O)O)C)C)C2C1)C)C(=O)O)C
|
795.00 |
unknown |
https://doi.org/10.1002/CBDV.200800128 |
> Lipids and lipid-like molecules / Prenol lipids / Terpene lactones
|
(1S,6S,9S,10S)-10-hydroxy-2,2,10-trimethyl-8-oxatricyclo[7.3.1.01,6]tridec-11-ene-4,7-dione
|
21589283 |
Click to see
CC1(CC(=O)CC2C13CC(C(C=C3)(C)O)OC2=O)C
|
264.32 |
unknown |
via CMAUP database |
5-Hydroxy-4-nor-3-oxa-5alpha-cholestan-2-one
|
11079680 |
Click to see
CC(C)CCCC(C)C1CCC2C1(CCC3C2CCC4(C3(CC(=O)O4)C)O)C
|
390.60 |
unknown |
via CMAUP database |
> Lipids and lipid-like molecules / Prenol lipids / Triterpenoids
|
(2R,alphaS)-alpha-[3-[(2R,4aalpha,8abeta)-6beta-[(2S,5R)-5-Bromo-2,6,6-trimethyltetrahydro-2H-pyran-2-yl]octahydro-8a-methylpyrano[3,2-b]pyran-2beta-yl]-3-butenyl]tetrahydro-alpha',alpha',2-trimethyl-2beta,5alpha-furandimethanol diacetate
|
23425821 |
Click to see
CC(=O)OC(CCC(=C)C1CCC2C(O1)(CCC(O2)C3(CCC(C(O3)(C)C)Br)C)C)C4(CCC(O4)C(C)(C)OC(=O)C)C
|
671.70 |
unknown |
via CMAUP database |
3alpha-3-Hydroxytirucalla-7,24-dien-21-oic acid
|
15559097 |
Click to see
CC(=CCCC(C1CCC2(C1(CCC3C2=CCC4C3(CCC(C4(C)C)O)C)C)C)C(=O)O)C
|
456.70 |
unknown |
https://doi.org/10.1016/J.FITOTE.2008.02.012 https://doi.org/10.1002/CBDV.200800128 |
Magireol A
|
23425822 |
Click to see
CC(=CCCC(C)(C(CCC(C)(C1CCC2C(O1)(CCC(O2)C3(CCC(C(O3)(C)C)Br)C)C)O)O)O)C
|
589.60 |
unknown |
via CMAUP database |
Magireol B
|
23425823 |
Click to see
CC(=CCCC(C)(C(CCC(=C)C1CCC2C(O1)(CCC(O2)C3(CCC(C(O3)(C)C)Br)C)C)O)O)C
|
571.60 |
unknown |
via CMAUP database |
Teurilene
|
185415 |
Click to see
CC(=CCCC(C)(C1CCC(O1)(C)C2CCC(O2)C3(CCC(O3)C(C)(CCC=C(C)C)O)C)O)C
|
492.70 |
unknown |
via CMAUP database |
Thyrsiferol
|
10984902 |
Click to see
CC1(C(CCC(O1)(C)C2CCC3(C(O2)CCC(O3)C(C)(CCC(C4(CCC(O4)C(C)(C)O)C)O)O)C)Br)C
|
605.60 |
unknown |
via CMAUP database |
Thyrsiferyl 23-acetate
|
125904 |
Click to see
CC(=O)OC(C)(C)C1CCC(O1)(C)C(CCC(C)(C2CCC3C(O2)(CCC(O3)C4(CCC(C(O4)(C)C)Br)C)C)O)O
|
647.70 |
unknown |
via CMAUP database |
> Lipids and lipid-like molecules / Steroids and steroid derivatives / Cholestane steroids / Cholesterols and derivatives
|
Cholest-4-en-3-one
|
91477 |
Click to see
CC(C)CCCC(C)C1CCC2C1(CCC3C2CCC4=CC(=O)CCC34C)C
|
384.60 |
unknown |
via CMAUP database |
Cholesterol
|
5997 |
Click to see
CC(C)CCCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)O)C)C
|
386.70 |
unknown |
via CMAUP database |
> Lipids and lipid-like molecules / Steroids and steroid derivatives / Stigmastanes and derivatives
|
17-(5-ethyl-6-methylhept-3-en-2-yl)-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol
|
122544 |
Click to see
CCC(C=CC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)O)C)C)C(C)C
|
412.70 |
unknown |
https://doi.org/10.1002/CBDV.200800128 |
17-(5-ethyl-6-methylheptan-2-yl)-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol
|
86821 |
Click to see
CCC(CCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)O)C)C)C(C)C
|
414.70 |
unknown |
https://doi.org/10.1002/CBDV.200800128 |
17-(5-ethyl-6-methylheptan-2-yl)-10,13-dimethyl-2,3,6,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol
|
72740710 |
Click to see
CCC(CCC(C)C1CCC2C1(CCC3C2CCC4=CC(CCC34C)O)C)C(C)C
|
414.70 |
unknown |
https://doi.org/10.1002/CBDV.200800128 |
Beta-Sitosterol
|
222284 |
Click to see
CCC(CCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)O)C)C)C(C)C
|
414.70 |
unknown |
https://doi.org/10.1002/CBDV.200800128 |
beta-Sitosterol 3-O-beta-D-galactopyranoside
|
296119 |
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 |
https://doi.org/10.1002/CBDV.200800128 |
Lawsaritol
|
14890646 |
Click to see
CCC(CCC(C)C1CCC2C1(CCC3C2CCC4=CC(CCC34C)O)C)C(C)C
|
414.70 |
unknown |
https://doi.org/10.1002/CBDV.200800128 |
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 |
https://doi.org/10.1002/CBDV.200800128 |
Stigmasterol
|
5280794 |
Click to see
CCC(C=CC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)O)C)C)C(C)C
|
412.70 |
unknown |
https://doi.org/10.1002/CBDV.200800128 |
> Organic acids and derivatives / Carboxylic acids and derivatives / Carboxylic acid derivatives / Carboxylic acid esters
|
(2R)-2beta-[(R)-1-Bromopropyl]-5beta,7alpha-dichloro-8alpha-[(2E)-2-pentene-4-ynyl]oxocane-4alpha-ol acetate
|
636623 |
Click to see
CCC(C1CC(C(CC(C(O1)CC=CC#C)Cl)Cl)OC(=O)C)Br
|
426.20 |
unknown |
via CMAUP database |
(2R)-2beta-[(R)-1-Bromopropyl]-5beta,7alpha-dichloro-8alpha-[(2Z)-2-pentene-4-ynyl]oxocane-4alpha-ol acetate
|
643642 |
Click to see
CCC(C1CC(C(CC(C(O1)CC=CC#C)Cl)Cl)OC(=O)C)Br
|
426.20 |
unknown |
via CMAUP database |
Laurencienyne
|
102117155 |
Click to see
CCC(C1CC(C(CC(C(O1)CC=CC#C)Cl)Cl)OC(=O)C)Br
|
426.20 |
unknown |
via CMAUP database |
> Organic acids and derivatives / Carboxylic acids and derivatives / Tricarboxylic acids and derivatives
|
(2aS,betaR)-6,8bbeta-Dimethyl-beta-bromo-4beta,10beta-di(acetyloxy)-2abeta-hydroxy-1,2,2a,2balpha,3,4,4abeta,5,6,7,8b,9,10,10abeta-tetradecahydrocyclobuta[a]phenanthrene-6beta-ethanol 6-acetate
|
15385758 |
Click to see
CC(=O)OCC(C1(CC=C2C(C1)C(CC3C2(CC(C4C3(CC4)O)OC(=O)C)C)OC(=O)C)C)Br
|
541.50 |
unknown |
via CMAUP database |
> Organic oxygen compounds / Organooxygen compounds / Alcohols and polyols / Secondary alcohols / Cyclohexanols
|
Prevezol D
|
10938244 |
Click to see
CC1=C2CCC(C(CC2C(C1)(C)C3CCC(C(C3)Br)(C)O)O)(C)O
|
401.40 |
unknown |
via CMAUP database |
Prevezol E
|
11143863 |
Click to see
CC1(CCC2C(CC1O)C(CC2=C)(C)C3CCC(C(C3)Br)(C)O)O
|
401.40 |
unknown |
via CMAUP database |
> Organic oxygen compounds / Organooxygen compounds / Alcohols and polyols / Tertiary alcohols
|
(2aS,betaR)-6,8bbeta-Dimethyl-2abeta,4beta,10beta-trihydroxy-1,2,2a,2balpha,3,4,4abeta,5,6,7,8b,9,10,10abeta-tetradecahydro-beta-bromocyclobuta[a]phenanthrene-6beta-ethanol
|
23428153 |
Click to see
CC1(CC=C2C(C1)C(CC3C2(CC(C4C3(CC4)O)O)C)O)C(CO)Br
|
415.40 |
unknown |
via CMAUP database |
3-(6-hydroxy-2,6-dimethyl-2,4a,5,7,8,8a-hexahydro-1H-naphthalen-1-yl)propanoic acid
|
85373914 |
Click to see
CC1C=CC2CC(CCC2C1CCC(=O)O)(C)O
|
252.35 |
unknown |
https://doi.org/10.1002/CBDV.200800128 |
> Organic oxygen compounds / Organooxygen compounds / Carbohydrates and carbohydrate conjugates / Glycosyl compounds / C-glycosyl compounds
|
(2R,3R,5R)-2-[[(2S,3S,5R)-3-bromo-5-[(1R)-1-bromopropyl]oxolan-2-yl]methyl]-5-[(1R)-1-bromoprop-2-ynyl]oxolan-3-ol
|
14412604 |
Click to see
CCC(C1CC(C(O1)CC2C(CC(O2)C(C#C)Br)O)Br)Br
|
489.00 |
unknown |
via CMAUP database |
(2R,3R,5R)-5-[(1R)-1-bromoprop-2-ynyl]-2-[[(2S,3S,5S,6R)-3,5-dibromo-6-ethyloxan-2-yl]methyl]oxolan-3-ol
|
14412602 |
Click to see
CCC1C(CC(C(O1)CC2C(CC(O2)C(C#C)Br)O)Br)Br
|
489.00 |
unknown |
via CMAUP database |
[(2R,3R,5R)-2-[[(2S,3S,5S)-3-bromo-5-[(1R)-1-bromopropyl]oxolan-2-yl]methyl]-5-[(1S)-1-bromoprop-2-ynyl]oxolan-3-yl] acetate
|
23426959 |
Click to see
CCC(C1CC(C(O1)CC2C(CC(O2)C(C#C)Br)OC(=O)C)Br)Br
|
531.10 |
unknown |
via CMAUP database |
Scanlonenyne
|
21601935 |
Click to see
CCC1C(CC(C(O1)CC(=O)CCC=CC#C)O)Br
|
329.23 |
unknown |
via CMAUP database |
> Organic oxygen compounds / Organooxygen compounds / Carbohydrates and carbohydrate conjugates / Monosaccharides
|
(3,4,5,6-Tetrahydroxyoxan-2-yl)methyl acetate
|
536270 |
Click to see
CC(=O)OCC1C(C(C(C(O1)O)O)O)O
|
222.19 |
unknown |
https://doi.org/10.1002/CBDV.200800128 |
[(2R,3S,4S,5R,6S)-3,4,5,6-tetrahydroxyoxan-2-yl]methyl acetate
|
10443517 |
Click to see
CC(=O)OCC1C(C(C(C(O1)O)O)O)O
|
222.19 |
unknown |
https://doi.org/10.1002/CBDV.200800128 |
> Organic oxygen compounds / Organooxygen compounds / Carbohydrates and carbohydrate conjugates / Monosaccharides / Pentoses
|
[(E,2S,3S)-3-bromo-1-[(2R,3R,5S)-5-[(1R)-1-bromoprop-2-ynoxy]-3-hydroxyoxolan-2-yl]oct-5-en-2-yl] acetate
|
23426371 |
Click to see
CCC=CCC(C(CC1C(CC(O1)OC(C#C)Br)O)OC(=O)C)Br
|
468.20 |
unknown |
via CMAUP database |
> Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Cyclic ketones / Cyclohexenones
|
(2S)-2alpha-Bromo-3,4beta,7,7aalpha-tetramethyl-3alpha,3aalpha-ethano-2,3,3a,4,5,7a-hexahydro-1H-indene-5-one
|
21778407 |
Click to see
CC1C(=O)C=C(C2(C13CCC3(C(C2)Br)C)C)C
|
297.23 |
unknown |
via CMAUP database |
(3R,4R,4aR)-3-hydroxy-1,4,4a,7-tetramethyl-4,5,8,9-tetrahydro-3H-benzo[7]annulen-2-one
|
639667 |
Click to see
CC1C(C(=O)C(=C2C1(CC=C(CC2)C)C)C)O
|
234.33 |
unknown |
via CMAUP database |
3,4,4a,5,8,9-Hexahydro-3beta-hydroxy-1,4alpha,4aalpha,7-tetramethyl-2H-benzocyclohepten-2-one
|
23425283 |
Click to see
CC1C(C(=O)C(=C2C1(CC=C(CC2)C)C)C)O
|
234.33 |
unknown |
via CMAUP database |
> Organic oxygen compounds / Organooxygen compounds / Ethers / Dialkyl ethers
|
Obtusenyne
|
11002075 |
Click to see
CCC1C(CC=CCC(C(O1)CC=CC#C)Cl)Br
|
331.67 |
unknown |
via CMAUP database |
> Organohalogen compounds / Alkyl halides / Cyclohexyl halides
|
Caespitol
|
14314413 |
Click to see
CC1(C(CC(C(O1)(C)C2CCC(C(C2)Br)(C)Cl)O)Br)C
|
432.60 |
unknown |
via CMAUP database |
Isocaespitol
|
14314415 |
Click to see
CC1(C(CC(C(O1)(C)C2CCC(C(C2)Cl)(C)Br)O)Br)C
|
432.60 |
unknown |
via CMAUP database |
> Organohalogen compounds / Halohydrins / Bromohydrins
|
(2R,3R,4R,4aR)-1,4,4a,7-Tetramethyl-3-bromo-3,4,4a,5,8,9-hexahydro-2H-benzocycloheptene-2-ol
|
11688022 |
Click to see
CC1C(C(C(=C2C1(CC=C(CC2)C)C)C)O)Br
|
299.25 |
unknown |
via CMAUP database |
> Organoheterocyclic compounds / Benzopyrans
|
(2R,4aalpha)-2beta-Vinyl-2,5,5,8abeta-tetramethyl-6beta-bromooctahydro-2H-1-benzopyran
|
11771060 |
Click to see
CC1(C2CCC(OC2(CCC1Br)C)(C)C=C)C
|
301.26 |
unknown |
via CMAUP database |
Dactyloxene D
|
21773084 |
Click to see
CC1CCC(=C)C2C1(OC(CC2)(C)C=C)C
|
220.35 |
unknown |
via CMAUP database |
> Organoheterocyclic compounds / Furofurans
|
(1R,3R,5E,6S,7R,9S)-5-(1-bromopropylidene)-9-[(Z,1R)-1-chloropent-2-en-4-ynyl]-4,8-dioxatricyclo[4.2.1.03,7]nonane
|
21637507 |
Click to see
CCC(=C1C2C(C3CC(C2O3)O1)C(C=CC#C)Cl)Br
|
343.64 |
unknown |
via CMAUP database |
(2R,3'S,3aR,5R,5'S,6aR)-3'-bromo-5'-[(1R)-1-bromopropyl]-2-[(1R)-1-bromoprop-2-ynyl]spiro[3,3a,6,6a-tetrahydro-2H-furo[3,2-b]furan-5,2'-oxolane]
|
101277262 |
Click to see
CCC(C1CC(C2(O1)CC3C(O2)CC(O3)C(C#C)Br)Br)Br
|
487.00 |
unknown |
via CMAUP database |
> Organoheterocyclic compounds / Naphthofurans
|
(1R,6S,8R,12S,15S)-6-hydroxy-3,15-dimethyl-5,14-dioxatetracyclo[6.6.1.02,6.012,15]pentadec-2-ene-4,13-dione
|
14312886 |
Click to see
CC1=C2C3C4(C(CCCC4C(=O)O3)CC2(OC1=O)O)C
|
278.30 |
unknown |
https://doi.org/10.1002/CBDV.200800128 |
(1R,6S,8R,15S)-3,15-dimethyl-5,14-dioxatetracyclo[6.6.1.02,6.012,15]pentadeca-2,11-diene-4,13-dione
|
11579781 |
Click to see
CC1=C2C(CC3CCC=C4C3(C2OC4=O)C)OC1=O
|
260.28 |
unknown |
https://doi.org/10.1002/CBDV.200800128 |
(1R,6S,8R,15S)-6-hydroxy-3,15-dimethyl-5,14-dioxatetracyclo[6.6.1.02,6.012,15]pentadeca-2,11-diene-4,13-dione
|
16109809 |
Click to see
CC1=C2C3C4(C(CCC=C4C(=O)O3)CC2(OC1=O)O)C
|
276.28 |
unknown |
https://doi.org/10.1002/CBDV.200800128 |
(1R,8R,15S)-3,15-dimethyl-5,14-dioxatetracyclo[6.6.1.02,6.012,15]pentadeca-2(6),3,11-trien-13-one
|
101267857 |
Click to see
CC1=COC2=C1C3C4(C(C2)CCC=C4C(=O)O3)C
|
244.28 |
unknown |
https://doi.org/10.1002/CBDV.200800128 |
(1R,8S,12S,15S)-3,15-dimethyl-5,14-dioxatetracyclo[6.6.1.02,6.012,15]pentadeca-2(6),3-diene-7,13-dione
|
101591710 |
Click to see
CC1=COC2=C1C3C4(C(C2=O)CCCC4C(=O)O3)C
|
260.28 |
unknown |
https://doi.org/10.1016/J.FITOTE.2008.02.012 |
(1R,8S,15S)-3,15-dimethyl-5,14-dioxatetracyclo[6.6.1.02,6.012,15]pentadeca-2(6),3,11-triene-7,13-dione
|
162888824 |
Click to see
CC1=COC2=C1C3C4(C(C2=O)CCC=C4C(=O)O3)C
|
258.27 |
unknown |
https://doi.org/10.1016/J.FITOTE.2008.02.012 |
(2aR)-4,5,5abeta,6,9bbeta,9cbeta-Hexahydro-9,9c-dimethyl-3H-naphtho[1,8-bc:3,2-b']difuran-2(2aH)-one
|
14307935 |
Click to see
CC1=COC2=C1C3C4(C(C2)CCCC4C(=O)O3)C
|
246.30 |
unknown |
https://doi.org/10.1002/CBDV.200800128 |
(3,15-Dimethyl-4,13-dioxo-5,14-dioxatetracyclo[6.6.1.02,6.012,15]pentadec-2-en-11-yl) 2-methylbut-2-enoate
|
162951727 |
Click to see
CC=C(C)C(=O)OC1CCC2CC3C(=C(C(=O)O3)C)C4C2(C1C(=O)O4)C
|
360.40 |
unknown |
https://doi.org/10.1002/CBDV.200800128 |
[(1R,6S,8R,11S,12S,15S)-3,15-dimethyl-4,13-dioxo-5,14-dioxatetracyclo[6.6.1.02,6.012,15]pentadec-2-en-11-yl] (2R)-2-methylbutanoate
|
162853214 |
Click to see
CCC(C)C(=O)OC1CCC2CC3C(=C(C(=O)O3)C)C4C2(C1C(=O)O4)C
|
362.40 |
unknown |
https://doi.org/10.1002/CBDV.200800128 |
[(1R,6S,8R,11S,12S,15S)-3,15-dimethyl-4,13-dioxo-5,14-dioxatetracyclo[6.6.1.02,6.012,15]pentadec-2-en-11-yl] (Z)-2-methylbut-2-enoate
|
162951728 |
Click to see
CC=C(C)C(=O)OC1CCC2CC3C(=C(C(=O)O3)C)C4C2(C1C(=O)O4)C
|
360.40 |
unknown |
https://doi.org/10.1002/CBDV.200800128 |
3,15-Dimethyl-5,14-dioxatetracyclo[6.6.1.02,6.012,15]pentadeca-2,11-diene-4,13-dione
|
73018327 |
Click to see
CC1=C2C(CC3CCC=C4C3(C2OC4=O)C)OC1=O
|
260.28 |
unknown |
https://doi.org/10.1002/CBDV.200800128 |
3,15-Dimethyl-5,14-dioxatetracyclo[6.6.1.02,6.012,15]pentadeca-2(6),3-diene-7,13-dione
|
162923925 |
Click to see
CC1=COC2=C1C3C4(C(C2=O)CCCC4C(=O)O3)C
|
260.28 |
unknown |
https://doi.org/10.1016/J.FITOTE.2008.02.012 |
3,15-Dimethyl-5,14-dioxatetracyclo[6.6.1.02,6.012,15]pentadeca-2(6),3,11-trien-13-one
|
3477731 |
Click to see
CC1=COC2=C1C3C4(C(C2)CCC=C4C(=O)O3)C
|
244.28 |
unknown |
https://doi.org/10.1002/CBDV.200800128 |
3,15-Dimethyl-5,14-dioxatetracyclo[6.6.1.02,6.012,15]pentadeca-2(6),3,11-triene-7,13-dione
|
162888823 |
Click to see
CC1=COC2=C1C3C4(C(C2=O)CCC=C4C(=O)O3)C
|
258.27 |
unknown |
https://doi.org/10.1016/J.FITOTE.2008.02.012 |
6-Hydroxy-3,15-dimethyl-5,14-dioxatetracyclo[6.6.1.02,6.012,15]pentadec-2-ene-4,13-dione
|
14312885 |
Click to see
CC1=C2C3C4(C(CCCC4C(=O)O3)CC2(OC1=O)O)C
|
278.30 |
unknown |
https://doi.org/10.1002/CBDV.200800128 |
6-Hydroxy-3,15-dimethyl-5,14-dioxatetracyclo[6.6.1.02,6.012,15]pentadeca-2,11-diene-4,13-dione
|
162983594 |
Click to see
CC1=C2C3C4(C(CCC=C4C(=O)O3)CC2(OC1=O)O)C
|
276.28 |
unknown |
https://doi.org/10.1002/CBDV.200800128 |
> Organoheterocyclic compounds / Oxocins
|
(2S,3S,5Z,8S)-3-Chloro-2-[(E)-pent-2-en-4-ynyl]-8-[(E)-prop-1-enyl]-3,4,7,8-tetrahydro-2H-oxocine
|
15602162 |
Click to see
CC=CC1CC=CCC(C(O1)CC=CC#C)Cl
|
250.76 |
unknown |
via CMAUP database |
(2S)-2alpha-[(R)-1-Bromopropyl]-7alpha-chloro-2,3,6,7-tetrahydro-8alpha-[(2E)-2-pentene-4-ynyl]-8H-oxocin
|
11131368 |
Click to see
CCC(C1CC=CCC(C(O1)CC=CC#C)Cl)Br
|
331.67 |
unknown |
via CMAUP database |
trans-Pinnatifidenyne
|
22832857 |
Click to see
CCC(C1CC=CCC(C(O1)CC=CC#C)Cl)Br
|
331.67 |
unknown |
via CMAUP database |
> Phenylpropanoids and polyketides / Cinnamic acids and derivatives / Hydroxycinnamic acids and derivatives / Coumaric acids and derivatives
|
Decursidate
|
102004630 |
Click to see
COC1=C(C=CC(=C1)C=CC(=O)OCC(C2=CC=C(C=C2)O)O)O
|
330.30 |
unknown |
https://doi.org/10.1002/CBDV.200800128 |