> Benzenoids / Fluorenes
|
Malfodicfsixpo-kouxddqnsa-
|
10573587 |
Click to see
CC1CC(C(NC1)C(C)C2=C(C3=C(C=C2)C4CC=C5CC(CCC5(C4C3)C)O)C)O
|
409.60 |
unknown |
via CMAUP database |
Veratramine
|
6070 |
Click to see
CC1CC(C(NC1)C(C)C2=C(C3=C(C=C2)C4CC=C5CC(CCC5(C4C3)C)O)C)O
|
409.60 |
unknown |
via CMAUP database |
Veratrosine
|
23616879 |
Click to see
CC1CC(C(NC1)C(C)C2=C(C3=C(C=C2)C4CC=C5CC(CCC5(C4C3)C)OC6C(C(C(C(O6)CO)O)O)O)C)O
|
571.70 |
unknown |
via CMAUP database |
> Hydrocarbon derivatives / Tropones
|
Colchicine
|
6167 |
Click to see
CC(=O)NC1CCC2=CC(=C(C(=C2C3=CC=C(C(=O)C=C13)OC)OC)OC)OC
|
399.40 |
unknown |
via CMAUP database |
> Lipids and lipid-like molecules / Prenol lipids / Monoterpenoids / Acyclic monoterpenoids
|
beta-OCIMENE, (3E)-
|
5281553 |
Click to see
CC(=CCC=C(C)C=C)C
|
136.23 |
unknown |
https://doi.org/10.1007/BF00630335 |
Linalool, (+/-)-
|
6549 |
Click to see
CC(=CCCC(C)(C=C)O)C
|
154.25 |
unknown |
https://doi.org/10.1007/BF00630335 |
> Lipids and lipid-like molecules / Prenol lipids / Monoterpenoids / Aromatic monoterpenoids
|
p-CYMENE
|
7463 |
Click to see
CC1=CC=C(C=C1)C(C)C
|
134.22 |
unknown |
https://doi.org/10.1007/BF00630335 |
> Lipids and lipid-like molecules / Prenol lipids / Monoterpenoids / Bicyclic monoterpenoids
|
1,7,7-Trimethylbicyclo[2.2.1]heptan-2-ol
|
64685 |
Click to see
CC1(C2CCC1(C(C2)O)C)C
|
154.25 |
unknown |
https://doi.org/10.1007/BF00630335 |
alpha-PINENE
|
6654 |
Click to see
CC1=CCC2CC1C2(C)C
|
136.23 |
unknown |
https://doi.org/10.1007/BF00630335 |
beta-Pinene
|
14896 |
Click to see
CC1(C2CCC(=C)C1C2)C
|
136.23 |
unknown |
https://doi.org/10.1007/BF00630335 |
Bornyl acetate
|
6448 |
Click to see
CC(=O)OC1CC2CCC1(C2(C)C)C
|
196.29 |
unknown |
https://doi.org/10.1007/BF00630335 |
Sabinen
|
18818 |
Click to see
CC(C)C12CCC(=C)C1C2
|
136.23 |
unknown |
https://doi.org/10.1007/BF00630335 |
> Lipids and lipid-like molecules / Prenol lipids / Monoterpenoids / Menthane monoterpenoids
|
2-Cyclohexen-1-ol, 1-methyl-4-(1-methylethyl)-, cis-
|
526657 |
Click to see
CC(C)C1CCC(C=C1)(C)O
|
154.25 |
unknown |
https://doi.org/10.1016/J.PHYTOL.2011.11.006 |
2-Cyclohexen-1-ol, 1-methyl-4-(1-methylethyl)-, trans-
|
122484 |
Click to see
CC(C)C1CCC(C=C1)(C)O
|
154.25 |
unknown |
https://doi.org/10.1016/J.PHYTOL.2011.11.006 |
4-Terpineol, (+/-)-
|
11230 |
Click to see
CC1=CCC(CC1)(C(C)C)O
|
154.25 |
unknown |
https://doi.org/10.1007/BF00630335 |
Alpha-Terpineol
|
17100 |
Click to see
CC1=CCC(CC1)C(C)(C)O
|
154.25 |
unknown |
https://doi.org/10.1007/BF00630335 |
Limonene, (+/-)-
|
22311 |
Click to see
CC1=CCC(CC1)C(=C)C
|
136.23 |
unknown |
https://doi.org/10.1007/BF00630335 |
Menthol
|
1254 |
Click to see
CC1CCC(C(C1)O)C(C)C
|
156.26 |
unknown |
https://doi.org/10.1007/BF00630335 |
Terpinolene
|
11463 |
Click to see
CC1=CCC(=C(C)C)CC1
|
136.23 |
unknown |
https://doi.org/10.1007/BF00630335 |
> Lipids and lipid-like molecules / Prenol lipids / Sesquiterpenoids
|
(1R,4aR)-4,7-dimethyl-1-propan-2-yl-1,2,4a,5,6,8a-hexahydronaphthalene
|
5315589 |
Click to see
CC1=CC2C(CC1)C(=CCC2C(C)C)C
|
204.35 |
unknown |
https://doi.org/10.1007/BF00630335 |
(1R,4S,4aR)-1,6-dimethyl-4-propan-2-yl-3,4,4a,7,8,8a-hexahydro-2H-naphthalen-1-ol
|
5315592 |
Click to see
CC1=CC2C(CCC(C2CC1)(C)O)C(C)C
|
222.37 |
unknown |
https://doi.org/10.1007/BF00630335 |
alpha-Cadinene, (+)-
|
12306048 |
Click to see
CC1=CC2C(CC1)C(=CCC2C(C)C)C
|
204.35 |
unknown |
https://doi.org/10.1007/BF00630335 |
alpha-Cadinol
|
10398656 |
Click to see
CC1=CC2C(CCC(C2CC1)(C)O)C(C)C
|
222.37 |
unknown |
https://doi.org/10.1007/BF00630335 |
beta Farnesene
|
15228937 |
Click to see
CCC(=C)CCC=C(C)CCC=C(C)C
|
206.37 |
unknown |
https://doi.org/10.1007/BF00630335 |
beta-CARYOPHYLLENE OXIDE
|
1742210 |
Click to see
CC1(CC2C1CCC3(C(O3)CCC2=C)C)C
|
220.35 |
unknown |
https://doi.org/10.1016/J.PHYTOL.2011.11.006 https://doi.org/10.1007/BF00630335 |
Caryophyllene
|
5281515 |
Click to see
CC1=CCCC(=C)C2CC(C2CC1)(C)C
|
204.35 |
unknown |
https://doi.org/10.1007/BF00630335 |
Caryophyllene epoxide
|
14350 |
Click to see
CC1(CC2C1CCC3(C(O3)CCC2=C)C)C
|
220.35 |
unknown |
https://doi.org/10.1016/J.PHYTOL.2011.11.006 https://doi.org/10.1007/BF00630335 |
Caryophyllene,alpha + beta mixt.
|
5354499 |
Click to see
CC1=CCCC(=C)C2CC(C2CC1)(C)C
|
204.35 |
unknown |
https://doi.org/10.1007/BF00630335 |
gamma-Muurolene
|
12313020 |
Click to see
CC1=CC2C(CC1)C(=C)CCC2C(C)C
|
204.35 |
unknown |
https://doi.org/10.1007/BF00630335 |
Humulene
|
5281520 |
Click to see
CC1=CCC(C=CCC(=CCC1)C)(C)C
|
204.35 |
unknown |
https://doi.org/10.1007/BF00630335 |
> Lipids and lipid-like molecules / Prenol lipids / Sesquiterpenoids / Aromadendrane sesquiterpenoids / 5,10-cycloaromadendrane sesquiterpenoids
|
Ledum camphor
|
22297324 |
Click to see
CC1CCC2C1C3C(C3(C)C)CCC2(C)O
|
222.37 |
unknown |
https://doi.org/10.1007/BF00630335 |
Palustrol
|
110745 |
Click to see
CC1CCC2(C1C3C(C3(C)C)CCC2C)O
|
222.37 |
unknown |
https://doi.org/10.1007/BF00630335 |
> Lipids and lipid-like molecules / Prenol lipids / Sesquiterpenoids / Eudesmane, isoeudesmane or cycloeudesmane sesquiterpenoids
|
(1S,2S,4aR,8S,8aS)-4a,8-dimethyl-2-propan-2-yl-1,2,3,4,5,6,7,8a-octahydronaphthalene-1,8-diol
|
101596820 |
Click to see
CC(C)C1CCC2(CCCC(C2C1O)(C)O)C
|
240.38 |
unknown |
https://doi.org/10.1007/BF00630335 |
> Lipids and lipid-like molecules / Prenol lipids / Sesquiterpenoids / Germacrane sesquiterpenoids
|
(S,1Z,6Z)-8-Isopropyl-1-methyl-5-methylenecyclodeca-1,6-diene
|
91723653 |
Click to see
CC1=CCCC(=C)C=CC(CC1)C(C)C
|
204.35 |
unknown |
https://doi.org/10.1007/BF00630335 |
Germacrene D
|
5317570 |
Click to see
CC1=CCCC(=C)C=CC(CC1)C(C)C
|
204.35 |
unknown |
https://doi.org/10.1007/BF00630335 |
> Lipids and lipid-like molecules / Prenol lipids / Sesterterpenoids / Scalarane sesterterpenoids
|
(4aS,6aR,6aS,8aR,12aR,14aR,14bR)-4,4,6a,6a,8a,11,11,14b-octamethyl-2,4a,5,6,8,9,10,12,12a,13,14,14a-dodecahydro-1H-picen-3-one
|
11877466 |
Click to see
CC1(CCC2(CC=C3C4(CCC5C(C(=O)CCC5(C4CCC3(C2C1)C)C)(C)C)C)C)C
|
424.70 |
unknown |
via CMAUP database |
Taraxerol acetate
|
94225 |
Click to see
CC(=O)OC1CCC2(C(C1(C)C)CCC3(C2CCC4(C3=CCC5(C4CC(CC5)(C)C)C)C)C)C
|
468.80 |
unknown |
via CMAUP database |
> Lipids and lipid-like molecules / Prenol lipids / Triterpenoids
|
[(1S,3R,6S,8R,11S,12S,15R,16R)-15-[(2R)-4-hydroxybutan-2-yl]-7,7,12,16-tetramethyl-6-pentacyclo[9.7.0.01,3.03,8.012,16]octadecanyl] acetate
|
59223573 |
Click to see
CC(CCO)C1CCC2(C1(CCC34C2CCC5C3(C4)CCC(C5(C)C)OC(=O)C)C)C
|
430.70 |
unknown |
https://doi.org/10.1016/J.PHYTOL.2011.11.006 |
[(1S,3R,6S,8R,11S,12S,15R,16R)-15-[(2R)-5-hydroxypentan-2-yl]-7,7,12,16-tetramethyl-6-pentacyclo[9.7.0.01,3.03,8.012,16]octadecanyl] acetate
|
59223477 |
Click to see
CC(CCCO)C1CCC2(C1(CCC34C2CCC5C3(C4)CCC(C5(C)C)OC(=O)C)C)C
|
444.70 |
unknown |
https://doi.org/10.1016/J.PHYTOL.2011.11.006 |
[(1S,3R,6S,8R,11S,12S,15R,16R)-7,7,12,16-tetramethyl-15-[(2R)-5-oxopentan-2-yl]-6-pentacyclo[9.7.0.01,3.03,8.012,16]octadecanyl] acetate
|
59223480 |
Click to see
CC(CCC=O)C1CCC2(C1(CCC34C2CCC5C3(C4)CCC(C5(C)C)OC(=O)C)C)C
|
442.70 |
unknown |
https://doi.org/10.1016/J.PHYTOL.2011.11.006 |
> Lipids and lipid-like molecules / Steroids and steroid derivatives / Steroidal alkaloids / 22,26-epiminocholestanes
|
(3S,8R,9S,10R,12S,13S,14S,17R)-10,13-dimethyl-17-[(1S)-1-[(3S)-3-methyl-2,3,4,5-tetrahydropyridin-6-yl]ethyl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-3,12-diol
|
101861833 |
Click to see
CC1CCC(=NC1)C(C)C2CCC3C2(C(CC4C3CC=C5C4(CCC(C5)O)C)O)C
|
413.60 |
unknown |
via CMAUP database |
> Lipids and lipid-like molecules / Steroids and steroid derivatives / Steroidal alkaloids / Cerveratrum-type alkaloids
|
[(1S,2S,6S,9S,10S,11R,12R,13S,14S,15S,18S,19S,22S,23R,25R)-10,12,13,14,23-pentahydroxy-6,10,19-trimethyl-24-oxa-4-azaheptacyclo[12.12.0.02,11.04,9.015,25.018,23.019,25]hexacosan-22-yl] 3,4-dimethoxybenzoate
|
23620249 |
Click to see
CC1CCC2C(C3C(CN2C1)C4CC56C(C4(C(C3O)O)O)CCC7C5(CCC(C7(O6)O)OC(=O)C8=CC(=C(C=C8)OC)OC)C)(C)O
|
657.80 |
unknown |
via CMAUP database |
Germerine
|
91800232 |
Click to see
CCC(C)C(=O)OC1C(C2C(CN3CC(CCC3C2(C)O)C)C4C1(C5C(CC6C7(C5(C4)OC6(C(CC7)OC(=O)C(C)(CC)O)O)C)O)O)O
|
693.90 |
unknown |
via CMAUP database |
Germidine
|
90478953 |
Click to see
CCC(C)C(=O)OC1C(C2C(CN3CC(CCC3C2(C)O)C)C4C1(C5C(CC6C7(C5(C4)OC6(C(CC7)OC(=O)C)O)C)O)O)O
|
635.80 |
unknown |
via CMAUP database |
Zygacine
|
21573746 |
Click to see
CC1CCC2C(C3C(CN2C1)C4CC56C(C4(C(C3O)O)O)CCC7C5(CCC(C7(O6)O)OC(=O)C)C)(C)O
|
535.70 |
unknown |
via CMAUP database |
> Lipids and lipid-like molecules / Steroids and steroid derivatives / Steroidal alkaloids / Jerveratrum-type alkaloids
|
(1R,3S,3'R,3'aS,4aR,6'S,6aS,6bS,7'aR,9R,11aS,11bS)-1,3-dihydroxy-3',6',10,11b-tetramethylspiro[1,2,3,4,4a,5,6,6a,6b,7,8,11a-dodecahydrobenzo[a]fluorene-9,2'-3a,4,5,6,7,7a-hexahydro-3H-furo[3,2-b]pyridine]-11-one
|
16723933 |
Click to see
CC1CC2C(C(C3(O2)CCC4C5CCC6CC(CC(C6(C5C(=O)C4=C3C)C)O)O)C)NC1
|
443.60 |
unknown |
via CMAUP database |
(3S,3'R,3'aS,6'S,6aS,6bS,7'aR,9S,11aS,11bR)-3',6',10,11b-tetramethylspiro[2,3,4,6,6a,6b,7,8,11,11a-decahydro-1H-benzo[a]fluorene-9,2'-3a,4,5,6,7,7a-hexahydro-3H-furo[3,2-b]pyridine]-3-ol
|
86287406 |
Click to see
CC1CC2C(C(C3(O2)CCC4C5CC=C6CC(CCC6(C5CC4=C3C)C)O)C)NC1
|
411.60 |
unknown |
via CMAUP database |
23-Methoxycyclopamine
|
101844722 |
Click to see
CC1CC2(C(C(C3(O2)CCC4C5CC=C6CC(CCC6(C5CC4=C3C)C)O)C)NC1)OC
|
441.60 |
unknown |
via CMAUP database |
Jervine
|
10098 |
Click to see
CC1CC2C(C(C3(O2)CCC4C5CC=C6CC(CCC6(C5C(=O)C4=C3C)C)O)C)NC1
|
425.60 |
unknown |
via CMAUP database |
methyl (3S,3'R,3'aS,6'S,6aS,6bS,7'aR,9R,11S,11aS,11bR)-3,11-dihydroxy-3',6',10,11b-tetramethylspiro[2,3,4,6,6a,6b,7,8,11,11a-decahydro-1H-benzo[a]fluorene-9,2'-3,3a,5,6,7,7a-hexahydrofuro[3,2-b]pyridine]-4'-carboxylate
|
16723827 |
Click to see
CC1CC2C(C(C3(O2)CCC4C5CC=C6CC(CCC6(C5C(C4=C3C)O)C)O)C)N(C1)C(=O)OC
|
485.70 |
unknown |
via CMAUP database |
> Lipids and lipid-like molecules / Steroids and steroid derivatives / Steroidal alkaloids / Solanidines and derivatives
|
Rubijervine
|
253295 |
Click to see
CC1CCC2C(C3C(N2C1)CC4C3(C(CC5C4CC=C6C5(CCC(C6)O)C)O)C)C
|
413.60 |
unknown |
via CMAUP database |
Solanidine
|
65727 |
Click to see
CC1CCC2C(C3C(N2C1)CC4C3(CCC5C4CC=C6C5(CCC(C6)O)C)C)C
|
397.60 |
unknown |
via CMAUP database |
> Organic acids and derivatives / Carboxylic acids and derivatives / Carboxylic acid derivatives / Carboxylic acid esters
|
Artemisyl acetate
|
524254 |
Click to see
CC(=CC(C(C)(C)C=C)OC(=O)C)C
|
196.29 |
unknown |
https://doi.org/10.1007/BF00630335 |
> Organic oxygen compounds / Organooxygen compounds / Alcohols and polyols / Secondary alcohols
|
3,3,6-Trimethylhepta-1,5-dien-4-ol
|
100197 |
Click to see
CC(=CC(C(C)(C)C=C)O)C
|
154.25 |
unknown |
https://doi.org/10.1007/BF00630335 |
> Organic oxygen compounds / Organooxygen compounds / Carbohydrates and carbohydrate conjugates / Sugar acids and derivatives
|
L-Tartaric acid
|
444305 |
Click to see
C(C(C(=O)O)O)(C(=O)O)O
|
150.09 |
unknown |
via CMAUP database |
> Organoheterocyclic compounds / Lactones / Gamma butyrolactones
|
(3R,3aS,9aS,9bS)-3,6,9-trimethyl-3,3a,4,5,9a,9b-hexahydroazuleno[4,5-b]furan-2,7-dione
|
442139 |
Click to see
CC1C2CCC(=C3C(C2OC1=O)C(=CC3=O)C)C
|
246.30 |
unknown |
https://doi.org/10.1007/BF00563842 |
Achillin
|
291264 |
Click to see
CC1C2CCC(=C3C(C2OC1=O)C(=CC3=O)C)C
|
246.30 |
unknown |
https://doi.org/10.1007/BF00563842 |
> Phenylpropanoids and polyketides / Flavonoids / O-methylated flavonoids / 6-O-methylated flavonoids
|
Axillarin
|
5281603 |
Click to see
COC1=C(C2=C(C=C1O)OC(=C(C2=O)OC)C3=CC(=C(C=C3)O)O)O
|
346.30 |
unknown |
via CMAUP database |
> Phenylpropanoids and polyketides / Flavonoids / O-methylated flavonoids / 7-O-methylated flavonoids
|
Cirsiliol
|
160237 |
Click to see
COC1=C(C(=C2C(=C1)OC(=CC2=O)C3=CC(=C(C=C3)O)O)O)OC
|
330.29 |
unknown |
via CMAUP database |
Fastigenin
|
162464 |
Click to see
COC1=C(C=CC(=C1)C2=CC(=O)C3=C(C(=C(C=C3O2)OC)OC)O)O
|
344.30 |
unknown |
via CMAUP database |
> Phenylpropanoids and polyketides / Stilbenes
|
4-[(E)-2-(3,5-dihydroxyphenyl)ethenyl]-2-methoxybenzene-1,3-diol
|
5315205 |
Click to see
COC1=C(C=CC(=C1O)C=CC2=CC(=CC(=C2)O)O)O
|
274.27 |
unknown |
via CMAUP database |
Resveratrol
|
445154 |
Click to see
C1=CC(=CC=C1C=CC2=CC(=CC(=C2)O)O)O
|
228.24 |
unknown |
via CMAUP database |