> Benzenoids
|
Arhimachalene
|
11458355 |
Click to see
CC1CCCC(C2=C1C=CC(=C2)C)(C)C
|
202.33 |
unknown |
via CMAUP database |
> Benzenoids / Benzene and substituted derivatives / Methoxybenzenes / Dimethoxybenzenes
|
3-(3',4'-Dimethoxyphenyl)prop-2-enyl isovalerate
|
6442914 |
Click to see
CC(C)CC(=O)OCC=CC1=CC(=C(C=C1)OC)OC
|
278.34 |
unknown |
via CMAUP database |
3,4-Dimethoxycinnamyl alcohol
|
5387770 |
Click to see
COC1=C(C=C(C=C1)C=CCO)OC
|
194.23 |
unknown |
via CMAUP database |
Methyleugenol
|
7127 |
Click to see
COC1=C(C=C(C=C1)CC=C)OC
|
178.23 |
unknown |
https://doi.org/10.1007/BF01961467 |
> Benzenoids / Benzene and substituted derivatives / Styrenes
|
Cinnamyl isovalerate
|
5355855 |
Click to see
CC(C)CC(=O)OCC=CC1=CC=CC=C1
|
218.29 |
unknown |
via CMAUP database |
> Benzenoids / Naphthalenes / Naphthalenecarboxylic acids and derivatives / Naphthalenecarboxylic acids
|
(7S,8R)-6-Methylidene-5-oxo-8-(3,4,5-trimethoxyphenyl)-7,8-dihydrobenzo[f][1,3]benzodioxole-7-carboxylic acid
|
11144085 |
Click to see
COC1=CC(=CC(=C1OC)OC)C2C(C(=C)C(=O)C3=CC4=C(C=C23)OCO4)C(=O)O
|
412.40 |
unknown |
via CMAUP database |
> Benzenoids / Naphthalenes / Phenylnaphthalenes
|
(2R)-2-[3-[(1R)-1-carboxy-2-(3,4-dihydroxyphenyl)ethoxy]carbonyl-2-(3,4-dihydroxyphenyl)-7,8-dihydroxy-1,2-dihydronaphthalene-1-carbonyl]oxy-3-(3,4-dihydroxyphenyl)propanoic acid
|
76324956 |
Click to see
C1=CC(=C(C=C1CC(C(=O)O)OC(=O)C2C(C(=CC3=C2C(=C(C=C3)O)O)C(=O)OC(CC4=CC(=C(C=C4)O)O)C(=O)O)C5=CC(=C(C=C5)O)O)O)O
|
718.60 |
unknown |
https://doi.org/10.1016/J.BMC.2014.01.009 |
> Benzenoids / Phenol ethers / Anisoles
|
3',4',5'-Trimethoxycinnamylisovalerate
|
6442915 |
Click to see
CC(C)CC(=O)OCC=CC1=CC(=C(C(=C1)OC)OC)OC
|
308.40 |
unknown |
via CMAUP database |
> Benzenoids / Phenols / Methoxyphenols
|
Eugenol
|
3314 |
Click to see
COC1=C(C=CC(=C1)CC=C)O
|
164.20 |
unknown |
https://doi.org/10.1007/BF01961467 |
Isoeugenol
|
853433 |
Click to see
CC=CC1=CC(=C(C=C1)O)OC
|
164.20 |
unknown |
https://doi.org/10.1007/BF01961467 |
> Hydrocarbon derivatives / Tropones / Tropolones
|
Nootkatin
|
238797 |
Click to see
CC(C)C1=CC(=O)C(=CC=C1CC=C(C)C)O
|
232.32 |
unknown |
via CMAUP database |
> Hydrocarbons / Unsaturated hydrocarbons / Branched unsaturated hydrocarbons
|
(1S,2R,5S,7S)-2,6,6,8-tetramethyltricyclo[5.2.2.01,5]undec-8-ene
|
101985700 |
Click to see
CC1CCC2C13CCC(C2(C)C)C(=C3)C
|
204.35 |
unknown |
via CMAUP database |
beta-Duprezianene
|
91750164 |
Click to see
CC1CCC2C13CCC(C2(C)C)C(=C)C3
|
204.35 |
unknown |
via CMAUP database |
Pseudowiddrene
|
15409431 |
Click to see
CC1=CCC2(C(=CCCC2(C)C)CC1)C
|
204.35 |
unknown |
via CMAUP database |
> Lignans, neolignans and related compounds
|
(2Z)-3-(3,4-dihydroxyphenyl)-2-[(3,4-dihydroxyphenyl)methylidene]-4-hydroxypentanedioic acid
|
57620293 |
Click to see
C1=CC(=C(C=C1C=C(C(C2=CC(=C(C=C2)O)O)C(C(=O)O)O)C(=O)O)O)O
|
376.30 |
unknown |
https://doi.org/10.1016/J.BMC.2014.01.009 |
> Lignans, neolignans and related compounds / Aryltetralin lignans
|
methyl (5R,6R,7R)-7-(hydroxymethyl)-5-(3,4,5-trimethoxyphenyl)-5,6,7,8-tetrahydrobenzo[f][1,3]benzodioxole-6-carboxylate
|
101618918 |
Click to see
COC1=CC(=CC(=C1OC)OC)C2C(C(CC3=CC4=C(C=C23)OCO4)CO)C(=O)OC
|
430.40 |
unknown |
via CMAUP database |
> Lignans, neolignans and related compounds / Aryltetralin lignans / 9,9p-dihydroxyaryltetralin lignans
|
Podophyllinic acid
|
134632 |
Click to see
COC1=CC(=CC(=C1OC)OC)C2C(C(C(C3=CC4=C(C=C23)OCO4)O)CO)C(=O)O
|
432.40 |
unknown |
via CMAUP database |
> Lignans, neolignans and related compounds / Cyclobutane lignans
|
(2R)-2-[(1R,2R,3R,4R)-2-[(1R)-1-carboxy-2-(3,4-dihydroxyphenyl)ethoxy]carbonyl-3,4-bis(3,4-dihydroxyphenyl)cyclobutanecarbonyl]oxy-3-(3,4-dihydroxyphenyl)propanoic acid
|
76335838 |
Click to see
C1=CC(=C(C=C1CC(C(=O)O)OC(=O)C2C(C(C2C(=O)OC(CC3=CC(=C(C=C3)O)O)C(=O)O)C4=CC(=C(C=C4)O)O)C5=CC(=C(C=C5)O)O)O)O
|
720.60 |
unknown |
https://doi.org/10.1016/J.BMC.2014.01.009 |
> Lignans, neolignans and related compounds / Furanoid lignans
|
(-)-Sesamin
|
382073 |
Click to see
C1C2C(COC2C3=CC4=C(C=C3)OCO4)C(O1)C5=CC6=C(C=C5)OCO6
|
354.40 |
unknown |
via CMAUP database |
> Lignans, neolignans and related compounds / Furanoid lignans / Tetrahydrofuran lignans / 7,9-epoxylignans
|
[(2R,3S,4S)-2-(1,3-benzodioxol-5-yl)-4-(1,3-benzodioxol-5-ylmethyl)oxolan-3-yl]methanol
|
11653313 |
Click to see
C1C(C(C(O1)C2=CC3=C(C=C2)OCO3)CO)CC4=CC5=C(C=C4)OCO5
|
356.40 |
unknown |
via CMAUP database |
> Lignans, neolignans and related compounds / Furanoid lignans / Tetrahydrofuran lignans / 9,9-epoxylignans / Dibenzylbutyrolactone lignans
|
(3E,4R)-4-(1,3-Benzodioxol-5-ylmethyl)-3-[(3,4,5-trimethoxyphenyl)methylidene]oxolan-2-one
|
11165431 |
Click to see
COC1=CC(=CC(=C1OC)OC)C=C2C(COC2=O)CC3=CC4=C(C=C3)OCO4
|
398.40 |
unknown |
via CMAUP database |
(3S,4R)-4-(1,3-benzodioxol-5-ylmethyl)-3-[(R)-hydroxy-(3,4,5-trimethoxyphenyl)methyl]oxolan-2-one
|
173676 |
Click to see
COC1=CC(=CC(=C1OC)OC)C(C2C(COC2=O)CC3=CC4=C(C=C3)OCO4)O
|
416.40 |
unknown |
via CMAUP database |
Hinokinin
|
442879 |
Click to see
C1C(C(C(=O)O1)CC2=CC3=C(C=C2)OCO3)CC4=CC5=C(C=C4)OCO5
|
354.40 |
unknown |
via CMAUP database |
Podorhizol
|
9931715 |
Click to see
COC1=CC(=CC(=C1OC)OC)C(C2C(COC2=O)CC3=CC4=C(C=C3)OCO4)O
|
416.40 |
unknown |
via CMAUP database |
Savinin
|
5281867 |
Click to see
C1C(C(=CC2=CC3=C(C=C2)OCO3)C(=O)O1)CC4=CC5=C(C=C4)OCO5
|
352.30 |
unknown |
via CMAUP database |
Yatein
|
442835 |
Click to see
COC1=CC(=CC(=C1OC)OC)CC2C(COC2=O)CC3=CC4=C(C=C3)OCO4
|
400.40 |
unknown |
via CMAUP database |
> Lignans, neolignans and related compounds / Lignan lactones
|
beta-Peltatin A methyl ether
|
159962 |
Click to see
COC1=CC(=CC(=C1OC)OC)C2C3C(CC4=C(C5=C(C=C24)OCO5)OC)COC3=O
|
428.40 |
unknown |
via CMAUP database |
Deoxypicropodophyllotoxin
|
11711021 |
Click to see
COC1=CC(=CC(=C1OC)OC)C2C3C(CC4=CC5=C(C=C24)OCO5)COC3=O
|
398.40 |
unknown |
via CMAUP database |
Deoxypodophyllotoxin
|
345501 |
Click to see
COC1=CC(=CC(=C1OC)OC)C2C3C(CC4=CC5=C(C=C24)OCO5)COC3=O
|
398.40 |
unknown |
via CMAUP database |
> Lignans, neolignans and related compounds / Lignan lactones / Podophyllotoxins
|
[(5S,5aR,8aS,9R)-8-oxo-9-(3,4,5-trimethoxyphenyl)-5a,6,8a,9-tetrahydro-5H-[2]benzofuro[5,6-f][1,3]benzodioxol-5-yl] acetate
|
14160031 |
Click to see
CC(=O)OC1C2COC(=O)C2C(C3=CC4=C(C=C13)OCO4)C5=CC(=C(C(=C5)OC)OC)OC
|
456.40 |
unknown |
via CMAUP database |
Picropodophyllin
|
72435 |
Click to see
COC1=CC(=CC(=C1OC)OC)C2C3C(COC3=O)C(C4=CC5=C(C=C24)OCO5)O
|
414.40 |
unknown |
via CMAUP database |
Podofilox
|
10607 |
Click to see
COC1=CC(=CC(=C1OC)OC)C2C3C(COC3=O)C(C4=CC5=C(C=C24)OCO5)O
|
414.40 |
unknown |
via CMAUP database |
> Lipids and lipid-like molecules / Fatty Acyls / Fatty alcohol esters
|
(2E,4Z)-Deca-2,4-dienyl isovalerate
|
6436644 |
Click to see
CCCCCC=CC=CCOC(=O)CC(C)C
|
238.37 |
unknown |
via CMAUP database |
> Lipids and lipid-like molecules / Prenol lipids / Diterpenoids
|
(1S,4aR,4bR,10aR)-1,4a-dimethyl-7-propan-2-yl-2,3,4,4b,5,6,10,10a-octahydrophenanthrene-1-carboxylic acid
|
6973653 |
Click to see
CC(C)C1=CC2=CCC3C(C2CC1)(CCCC3(C)C(=O)O)C
|
302.50 |
unknown |
via CMAUP database |
(1S,4R,5S,9S,10R,12S)-16-(2-hydroperoxypropan-2-yl)-5,9-dimethyl-13,14-dioxatetracyclo[10.2.2.01,10.04,9]hexadec-15-ene-5-carboxylic acid
|
97044524 |
Click to see
CC12CCCC(C1CCC34C2CC(C(=C3)C(C)(C)OO)OO4)(C)C(=O)O
|
366.40 |
unknown |
via CMAUP database |
15-Hydroperoxy-8alpha,12alpha-epidioxyabieta-13-ene-19-oic acid methyl ester
|
12149368 |
Click to see
CC12CCCC(C1CCC34C2CC(C(=C3)C(C)(C)OO)OO4)(C)C(=O)OC
|
380.50 |
unknown |
via CMAUP database |
4-Epicommunic acid
|
12303810 |
Click to see
CC(=CCC1C(=C)CCC2C1(CCCC2(C)C(=O)O)C)C=C
|
302.50 |
unknown |
via CMAUP database |
Abietal
|
443479 |
Click to see
CC(C)C1=CC2=CCC3C(CCCC3(C2CC1)C)(C)C=O
|
286.50 |
unknown |
via CMAUP database |
Abietic acid
|
10569 |
Click to see
CC(C)C1=CC2=CCC3C(C2CC1)(CCCC3(C)C(=O)O)C
|
302.50 |
unknown |
via CMAUP database |
Abietyl alcohol
|
443474 |
Click to see
CC(C)C1=CC2=CCC3C(CCCC3(C2CC1)C)(C)CO
|
288.50 |
unknown |
via CMAUP database |
CID 12306731
|
12306731 |
Click to see
CC(=CCO)CCC1C2(CCCC(C2CCC1(C)O)(C)C)C
|
308.50 |
unknown |
via CMAUP database |
Dehydroabietal
|
11694869 |
Click to see
CC(C)C1=CC2=C(C=C1)C3(CCCC(C3CC2)(C)C=O)C
|
284.40 |
unknown |
via CMAUP database |
Isopimaric Acid
|
442048 |
Click to see
CC1(CCC2C(=CCC3C2(CCCC3(C)C(=O)O)C)C1)C=C
|
302.50 |
unknown |
via CMAUP database |
Isopimarinol
|
15586712 |
Click to see
CC1(CCC2C(=CCC3C2(CCCC3(C)CO)C)C1)C=C
|
288.50 |
unknown |
via CMAUP database |
methyl (1S,4aR,5S,8aR)-5-[(E)-5-hydroxy-3-methylpent-3-enyl]-1,4a-dimethyl-6-methylidene-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylate
|
14060410 |
Click to see
CC(=CCO)CCC1C(=C)CCC2C1(CCCC2(C)C(=O)OC)C
|
334.50 |
unknown |
via CMAUP database |
methyl (1S,4R,5S,9S,10R,12S)-16-(2-hydroxypropan-2-yl)-5,9-dimethyl-13,14-dioxatetracyclo[10.2.2.01,10.04,9]hexadec-15-ene-5-carboxylate
|
12149369 |
Click to see
CC12CCCC(C1CCC34C2CC(C(=C3)C(C)(C)O)OO4)(C)C(=O)OC
|
364.50 |
unknown |
via CMAUP database |
Sandaracopimaradienediol
|
12313649 |
Click to see
CC1(CCC2C(=C1)CCC3C2(CCC(C3(C)CO)O)C)C=C
|
304.50 |
unknown |
via CMAUP database |
Sandaracopimaric Acid
|
221580 |
Click to see
CC1(CCC2C(=C1)CCC3C2(CCCC3(C)C(=O)O)C)C=C
|
302.50 |
unknown |
via CMAUP database |
Sandaracopimarinol
|
12314286 |
Click to see
CC1(CCC2C(=C1)CCC3C2(CCCC3(C)CO)C)C=C
|
288.50 |
unknown |
via CMAUP database |
> Lipids and lipid-like molecules / Prenol lipids / Monoterpenoids / Acyclic monoterpenoids
|
(+)-Linalyl acetate
|
6999980 |
Click to see
CC(=CCCC(C)(C=C)OC(=O)C)C
|
196.29 |
unknown |
via CMAUP database |
> Lipids and lipid-like molecules / Prenol lipids / Monoterpenoids / Aromatic monoterpenoids
|
Carvacrol
|
10364 |
Click to see
CC1=C(C=C(C=C1)C(C)C)O
|
150.22 |
unknown |
https://doi.org/10.1007/BF01961467 |
p-CYMENE
|
7463 |
Click to see
CC1=CC=C(C=C1)C(C)C
|
134.22 |
unknown |
https://doi.org/10.1007/BF01961467 |
Thymol
|
6989 |
Click to see
CC1=CC(=C(C=C1)C(C)C)O
|
150.22 |
unknown |
https://doi.org/10.1007/BF01961467 |
> Lipids and lipid-like molecules / Prenol lipids / Monoterpenoids / Monocyclic monoterpenoids
|
2-Ethylidene-4-isopropyl-4-cyclopentene-1,3-dione
|
76310416 |
Click to see
CC=C1C(=O)C=C(C1=O)C(C)C
|
164.20 |
unknown |
https://doi.org/10.1016/J.BMC.2014.01.009 |
> Lipids and lipid-like molecules / Prenol lipids / Sesquiterpenoids
|
(1aR,4aS,8aS)-4a,8,8-trimethyl-1,1a,4,5,6,7-hexahydrocyclopropa[j]naphthalene-2-carbaldehyde
|
12444332 |
Click to see
CC1(CCCC2(C13CC3C(=CC2)C=O)C)C
|
218.33 |
unknown |
via CMAUP database |
1-methyl-4-[(2S)-6-methylheptan-2-yl]benzene
|
101694025 |
Click to see
CC1=CC=C(C=C1)C(C)CCCC(C)C
|
204.35 |
unknown |
via CMAUP database |
Caryophyllene
|
5281515 |
Click to see
CC1=CCCC(=C)C2CC(C2CC1)(C)C
|
204.35 |
unknown |
https://doi.org/10.1007/BF01961467 |
Cuparene
|
86895 |
Click to see
CC1=CC=C(C=C1)C2(CCCC2(C)C)C
|
202.33 |
unknown |
via CMAUP database |
methyl (1S,4aR,5S,8aR)-1,4a-dimethyl-6-methylidene-5-(3-oxobutyl)-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylate
|
11255232 |
Click to see
CC(=O)CCC1C(=C)CCC2C1(CCCC2(C)C(=O)OC)C
|
306.40 |
unknown |
via CMAUP database |
Thujopsene
|
442402 |
Click to see
CC1=CCC2(CCCC(C23C1C3)(C)C)C
|
204.35 |
unknown |
via CMAUP database |
> Lipids and lipid-like molecules / Prenol lipids / Sesquiterpenoids / Cedrane and isocedrane sesquiterpenoids
|
(1R,2R,5S,7R)-2,6,6-Trimethyl-8-methylidenetricyclo[5.3.1.01,5]undecane
|
16213223 |
Click to see
CC1CCC2C13CCC(=C)C(C3)C2(C)C
|
204.35 |
unknown |
via CMAUP database |
(1R,2S,3R,5S,7S)-2,6,6,8-tetramethyltricyclo[5.3.1.01,5]undec-8-en-3-ol
|
15215015 |
Click to see
CC1C(CC2C13CC=C(C(C3)C2(C)C)C)O
|
220.35 |
unknown |
via CMAUP database |
(1S,2R,5S,7S)-2,6,6-trimethyl-8-methylidenetricyclo[5.3.1.01,5]undecan-4-one
|
12308774 |
Click to see
CC1CC(=O)C2C13CCC(=C)C(C3)C2(C)C
|
218.33 |
unknown |
via CMAUP database |
(1S,2R,5S,7S)-2,6,6,8-tetramethyltricyclo[5.3.1.01,5]undec-8-en-4-one
|
12308772 |
Click to see
CC1CC(=O)C2C13CC=C(C(C3)C2(C)C)C
|
218.33 |
unknown |
via CMAUP database |
(3R,8abeta)-3alpha,8,8-Trimethyl-6-methylenedecahydro-3aalpha,7alpha-methanoazulene-2-one
|
21576983 |
Click to see
CC1C(=O)CC2C13CCC(=C)C(C3)C2(C)C
|
218.33 |
unknown |
via CMAUP database |
(3R)-3alpha,6,8,8-Tetramethyl-2,3,4,7,8,8abeta-hexahydro-3aalpha,7alpha-methanoazulene-2(1H)-one
|
21576982 |
Click to see
CC1C(=O)CC2C13CC=C(C(C3)C2(C)C)C
|
218.33 |
unknown |
via CMAUP database |
[(1S,2R,5R,6S,7S)-2,6,8-trimethyl-6-tricyclo[5.3.1.01,5]undec-8-enyl]methanol
|
22211622 |
Click to see
CC1CCC2C13CC=C(C(C3)C2(C)CO)C
|
220.35 |
unknown |
via CMAUP database |
alpha-Cedrene
|
6431015 |
Click to see
CC1CCC2C13CC=C(C(C3)C2(C)C)C
|
204.35 |
unknown |
via CMAUP database |
beta-Cedrene
|
11106485 |
Click to see
CC1CCC2C13CCC(=C)C(C3)C2(C)C
|
204.35 |
unknown |
via CMAUP database |
Cedrenone
|
13335685 |
Click to see
CC1CCC2C13CC(C2(C)C)C(=CC3=O)C
|
218.33 |
unknown |
via CMAUP database |
Cedrol
|
65575 |
Click to see
CC1CCC2C13CCC(C(C3)C2(C)C)(C)O
|
222.37 |
unknown |
via CMAUP database |
> Lipids and lipid-like molecules / Prenol lipids / Sesquiterpenoids / Elemane sesquiterpenoids
|
(1S,2S,4S,5S)-5-ethenyl-2-(2-hydroxypropan-2-yl)-5-methyl-4-prop-1-en-2-ylcyclohexan-1-ol
|
14138884 |
Click to see
CC(=C)C1CC(C(CC1(C)C=C)O)C(C)(C)O
|
238.37 |
unknown |
via CMAUP database |
8-Acetoxyelemol
|
14138886 |
Click to see
CC(=C)C1CC(C(CC1(C)C=C)OC(=O)C)C(C)(C)O
|
280.40 |
unknown |
via CMAUP database |
Elemol
|
92138 |
Click to see
CC(=C)C1CC(CCC1(C)C=C)C(C)(C)O
|
222.37 |
unknown |
via CMAUP database |
> Lipids and lipid-like molecules / Prenol lipids / Terpene glycosides / Triterpene glycosides / Triterpene saponins
|
[(2S,3R,4S,5S)-3-[(2S,3R,4R,5R,6S)-3-[(2S,3R,4S,5R)-3-[(2S,3R,4R)-3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy-5-hydroxy-4-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxy-4,5-dihydroxy-6-methyloxan-2-yl]oxy-4,5-dihydroxyoxan-2-yl] (4aS,6aR,6aS,6bR,8R,8aR,9R,10R,11S,12aR,14bS)-10-[(2R,3R,4S,5S,6R)-3-[(2S,3R,4R)-3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-8,11-dihydroxy-9-(hydroxymethyl)-2,2,6a,6b,9,12a-hexamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylate
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21578040 |
Click to see
CC1C(C(C(C(O1)OC2C(COC(C2OC3C(C(CO3)(CO)O)O)OC4C(C(C(OC4OC5C(C(COC5OC(=O)C67CCC(CC6C8=CCC9C1(CC(C(C(C1C(CC9(C8(CC7)C)C)O)(C)CO)OC1C(C(C(C(O1)CO)O)O)OC1C(C(CO1)(CO)O)O)O)C)(C)C)O)O)C)O)O)O)O)O)O
|
1487.60 |
unknown |
via CMAUP database |
Madhucoside B
|
70697914 |
Click to see
CC1C(C(C(C(O1)OC2C(OC(C(C2O)OC3C(C(C(CO3)O)O)O)OC4C(C(OC(C4O)OC5C(C(COC5OC(=O)C67CCC(CC6C8=CCC9C1(CC(C(C(C1C(CC9(C8(CC7)C)C)O)(C)CO)OC1C(C(C(C(O1)CO)O)O)OC1C(C(CO1)(CO)O)O)O)C)(C)C)O)O)C)O)CO)O)O)O
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1517.60 |
unknown |
via CMAUP database |
> Lipids and lipid-like molecules / Prenol lipids / Triterpenoids
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(4aS,6aR,6aS,6bR,8aR,10S,12aS,14bS)-2,2,6a,6b,9,9,12a-heptamethyl-10-octanoyloxy-13-oxo-3,4,5,6,6a,7,8,8a,10,11,12,14b-dodecahydro-1H-picene-4a-carboxylic acid
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12097013 |
Click to see
CCCCCCCC(=O)OC1CCC2(C(C1(C)C)CCC3(C2C(=O)C=C4C3(CCC5(C4CC(CC5)(C)C)C(=O)O)C)C)C
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596.90 |
unknown |
via CMAUP database |
[(3S,4aS,6aR,6bS,8aR,12aR,14aR,14bR)-4,4,6a,6b,8a,11,11,14b-octamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-yl] acetate
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13019947 |
Click to see
CC(=O)OC1CCC2(C(C1(C)C)CCC3(C2CC=C4C3(CCC5(C4CC(CC5)(C)C)C)C)C)C
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468.80 |
unknown |
via CMAUP database |
> Lipids and lipid-like molecules / Steroids and steroid derivatives / Hydroxysteroids
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(1S,2S,4aR,4bS,7S,10aR)-7-ethenyl-2-hydroxy-1,4a,7-trimethyl-3,4,4b,5,6,8,10,10a-octahydro-2H-phenanthrene-1-carboxylic acid
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102193489 |
Click to see
CC1(CCC2C(=CCC3C2(CCC(C3(C)C(=O)O)O)C)C1)C=C
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318.40 |
unknown |
via CMAUP database |
3-Hydroxysandaracopimaric acid
|
101200911 |
Click to see
CC1(CCC2C(=C1)CCC3C2(CCC(C3(C)C(=O)O)O)C)C=C
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318.40 |
unknown |
via CMAUP database |
> Organic oxygen compounds / Organooxygen compounds / Alcohols and polyols / Cyclic alcohols and derivatives
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(1R,2R,5R,7R,8S)-2,6,6,8-tetramethyltricyclo[6.2.1.01,5]undecan-7-ol
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101985389 |
Click to see
CC1CCC2C13CCC(C3)(C(C2(C)C)O)C
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222.37 |
unknown |
via CMAUP database |
> Organic oxygen compounds / Organooxygen compounds / Alcohols and polyols / Tertiary alcohols
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Widdrol
|
94334 |
Click to see
CC1(CCCC2(C1=CCC(CC2)(C)O)C)C
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222.37 |
unknown |
via CMAUP database |
> Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Benzoquinones / P-benzoquinones
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Thymoquinone
|
10281 |
Click to see
CC1=CC(=O)C(=CC1=O)C(C)C
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164.20 |
unknown |
https://doi.org/10.1016/J.BMC.2014.01.009 |
> Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Cyclic ketones
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(2E)-4-methyl-2-(2-methylpropylidene)cyclopent-4-ene-1,3-dione
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76310417 |
Click to see
CC1=CC(=O)C(=CC(C)C)C1=O
|
164.20 |
unknown |
https://doi.org/10.1016/J.BMC.2014.01.009 |
(3R)-3alpha,7,7-Trimethyl-5-methylene-3a,4,5,6,7,7abeta-hexahydro-3aalpha,6alpha-ethano-1H-indene-2(3H)-one
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21576981 |
Click to see
CC1C(=O)CC2C13CCC(C2(C)C)C(=C)C3
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218.33 |
unknown |
via CMAUP database |
2-(2-Methylpropylidene)cyclopent-4-ene-1,3-dione
|
76328525 |
Click to see
CC(C)C=C1C(=O)C=CC1=O
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150.17 |
unknown |
https://doi.org/10.1016/J.BMC.2014.01.009 |
> Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Ketones
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(1R,2R,5R,8S)-2,6,6,8-tetramethyltricyclo[6.2.1.01,5]undecan-7-one
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21576985 |
Click to see
CC1CCC2C13CCC(C3)(C(=O)C2(C)C)C
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220.35 |
unknown |
via CMAUP database |
> Phenylpropanoids and polyketides / Cinnamic acids and derivatives / Hydroxycinnamic acids and derivatives / Coumaric acids and derivatives
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Rosmarinic acid
|
5281792 |
Click to see
C1=CC(=C(C=C1CC(C(=O)O)OC(=O)C=CC2=CC(=C(C=C2)O)O)O)O
|
360.30 |
unknown |
https://doi.org/10.1016/J.BMC.2014.01.009 |
> Phenylpropanoids and polyketides / Cinnamyl alcohols
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3,4,5-Trimethoxycinnamyl alcohol
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6436306 |
Click to see
COC1=CC(=CC(=C1OC)OC)C=CCO
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224.25 |
unknown |
via CMAUP database |
> Phenylpropanoids and polyketides / Flavonoids / Flavones
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5,6,7-Trihydroxy-2-(2,4,5-trihydroxyphenyl)-4H-1-benzopyran-4-one
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71331302 |
Click to see
C1=C(C(=CC(=C1O)O)O)C2=CC(=O)C3=C(O2)C=C(C(=C3O)O)O
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318.23 |
unknown |
via CMAUP database |
> Phenylpropanoids and polyketides / Isoflavonoids / Isoflav-2-enes / Isoflavones
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3',4'-Dihydroxy-5,2'-dimethoxy-6,7-methylendioxy isoflavone
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91421826 |
Click to see
COC1=C(C=CC(=C1O)O)C2=COC3=CC4=C(C(=C3C2=O)OC)OCO4
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358.30 |
unknown |
via CMAUP database |
> Phenylpropanoids and polyketides / Isoflavonoids / O-methylated isoflavonoids / 3-O-methylated isoflavonoids / 3-O-methylisoflavones
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Madhushazone
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12097014 |
Click to see
COC1=C(C(=C(C=C1)OC)OC)C2=COC3=CC4=C(C(=C3C2=O)OC)OCO4
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386.40 |
unknown |
via CMAUP database |
> Phenylpropanoids and polyketides / Isoflavonoids / O-methylated isoflavonoids / 4-O-methylated isoflavonoids / 4-O-methylisoflavones
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Madhusalmone
|
102072575 |
Click to see
COC1=CC(=CC(=C1OC)OC)C2=COC3=CC4=C(C(=C3C2=O)OC)OCOC5=C(C(=C6C(=C5)OC=C(C6=O)C7=CC(=C(C(=C7)OC)OC)OC)OC)OCO4
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772.70 |
unknown |
via CMAUP database |