> Benzenoids / Benzene and substituted derivatives / Benzoic acids and derivatives / Hydroxybenzoic acid derivatives
|
4-Hydroxybenzoic acid
|
135 |
Click to see
C1=CC(=CC=C1C(=O)O)O
|
138.12 |
unknown |
via CMAUP database |
> Benzenoids / Benzene and substituted derivatives / Benzoic acids and derivatives / Hydroxybenzoic acid derivatives / Gallic acid and derivatives
|
7-Methoxy-2H-1,3-benzodioxole-5-carboxylic acid
|
607309 |
Click to see
COC1=CC(=CC2=C1OCO2)C(=O)O
|
196.16 |
unknown |
via CMAUP database |
Syringic acid
|
10742 |
Click to see
COC1=CC(=CC(=C1O)OC)C(=O)O
|
198.17 |
unknown |
via CMAUP database |
> Benzenoids / Benzene and substituted derivatives / Benzoic acids and derivatives / Methoxybenzoic acids and derivatives / M-methoxybenzoic acids and derivatives
|
Vanillic Acid
|
8468 |
Click to see
COC1=C(C=CC(=C1)C(=O)O)O
|
168.15 |
unknown |
via CMAUP database |
> Benzenoids / Phenol ethers / Anisoles
|
(aR,7R)-Dihydroisosubamol
|
71620318 |
Click to see
COC1=C(C=C2C3=C(CCC(C2=C1)CO)C=C(C=C3)O)O
|
286.32 |
unknown |
via CMAUP database |
9,12-di-O-methylsubamol
|
71461983 |
Click to see
COCC1=CCC2=C(C=CC(=C2)OC)C3=CC(=C(C=C13)OC)O
|
312.40 |
unknown |
via CMAUP database |
> Benzenoids / Phenols / Methoxyphenols
|
Eugenol
|
3314 |
Click to see
COC1=C(C=CC(=C1)CC=C)O
|
164.20 |
unknown |
via CMAUP database |
Syringaldehyde
|
8655 |
Click to see
COC1=CC(=CC(=C1O)OC)C=O
|
182.17 |
unknown |
via CMAUP database |
Vanillin
|
1183 |
Click to see
COC1=C(C=CC(=C1)C=O)O
|
152.15 |
unknown |
via CMAUP database |
> Lignans, neolignans and related compounds / Furanoid lignans
|
(-)-Syringaresinol
|
11604108 |
Click to see
COC1=CC(=CC(=C1O)OC)C2C3COC(C3CO2)C4=CC(=C(C(=C4)OC)O)OC
|
418.40 |
unknown |
via CMAUP database |
Sesamin
|
72307 |
Click to see
C1C2C(COC2C3=CC4=C(C=C3)OCO4)C(O1)C5=CC6=C(C=C5)OCO6
|
354.40 |
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 |
Stearic Acid
|
5281 |
Click to see
CCCCCCCCCCCCCCCCCC(=O)O
|
284.50 |
unknown |
via CMAUP database |
> Lipids and lipid-like molecules / Fatty Acyls / Fatty acyl glycosides / Fatty acyl glycosides of mono- and disaccharides
|
(2R,3R,4S,5S,6R)-2-hex-3-enoxy-6-(hydroxymethyl)oxane-3,4,5-triol
|
125625 |
Click to see
CCC=CCCOC1C(C(C(C(O1)CO)O)O)O
|
262.30 |
unknown |
via CMAUP database |
> Lipids and lipid-like molecules / Fatty Acyls / Fatty alcohols / Long-chain fatty alcohols
|
Secosubamolide
|
16104910 |
Click to see
CCCCCCCCCCCCCC=C(C(C(=O)C)O)C(=O)OC
|
340.50 |
unknown |
via CMAUP database |
Secosubamolide A
|
24795973 |
Click to see
CCCCCCCCCCCCCCCC=C(C(C(=O)C)O)C(=O)OC
|
368.50 |
unknown |
via CMAUP database |
> Lipids and lipid-like molecules / Prenol lipids / Polyprenols
|
Ficaprenol 10
|
12866490 |
Click to see
CC(=CCCC(=CCCC(=CCCC(=CCCC(=CCCC(=CCCC(=CCCC(=CCCC(=CCCC(=CCO)C)C)C)C)C)C)C)C)C)C
|
699.20 |
unknown |
via CMAUP database |
Ficaprenol 11
|
11411688 |
Click to see
CC(=CCCC(=CCCC(=CCCC(=CCCC(=CCCC(=CCCC(=CCCC(=CCCC(=CCCC(=CCCC(=CCO)C)C)C)C)C)C)C)C)C)C)C
|
767.30 |
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 |
Gibberodione
|
11586727 |
Click to see
CC1CCC(=CC(=O)C1CCC(=O)C)C(C)C
|
236.35 |
unknown |
via CMAUP database |
> Lipids and lipid-like molecules / Prenol lipids / Sesquiterpenoids / Abscisic acids and derivatives
|
Abscisic acid
|
5280896 |
Click to see
CC1=CC(=O)CC(C1(C=CC(=CC(=O)O)C)O)(C)C
|
264.32 |
unknown |
via CMAUP database |
> Lipids and lipid-like molecules / Prenol lipids / Triterpenoids
|
Squalene
|
638072 |
Click to see
CC(=CCCC(=CCCC(=CCCC=C(C)CCC=C(C)CCC=C(C)C)C)C)C
|
410.70 |
unknown |
via CMAUP database |
> Lipids and lipid-like molecules / Steroids and steroid derivatives / Stigmastanes and derivatives
|
Beta-Sitosterol
|
222284 |
Click to see
CCC(CCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)O)C)C)C(C)C
|
414.70 |
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 |
Stigmasterol
|
5280794 |
Click to see
CCC(C=CC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)O)C)C)C(C)C
|
412.70 |
unknown |
via CMAUP database |
Stigmasterol glucoside
|
6602508 |
Click to see
CCC(C=CC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)OC5C(C(C(C(O5)CO)O)O)O)C)C)C(C)C
|
574.80 |
unknown |
via CMAUP database |
> Organic oxygen compounds / Organooxygen compounds / Carbohydrates and carbohydrate conjugates / Glycosyl compounds / O-glycosyl compounds
|
3-Methoxy-5-(beta-D-glucopyranosyloxymethyl)-7H-dibenzo[a,c]cycloheptene-2,9-diol
|
102345052 |
Click to see
COC1=C(C=C2C3=C(CC=C(C2=C1)COC4C(C(C(C(O4)CO)O)O)O)C=C(C=C3)O)O
|
446.40 |
unknown |
via CMAUP database |
3,9-Dimethoxy-5-(beta-D-glucopyranosyloxymethyl)-7H-dibenzo[a,c]cycloheptene-2-ol
|
71620321 |
Click to see
COC1=CC2=C(C=C1)C3=CC(=C(C=C3C(=CC2)COC4C(C(C(C(O4)CO)O)O)O)OC)O
|
460.50 |
unknown |
via CMAUP database |
Subavenoside A
|
71453067 |
Click to see
COC1=C(C=C2C3=CC=CC=C3CC=C(C2=C1)COC4C(C(C(C(O4)CO)O)O)O)O
|
430.40 |
unknown |
via CMAUP database |
> Organic oxygen compounds / Organooxygen compounds / Carbohydrates and carbohydrate conjugates / Glycosyl compounds / Phenolic glycosides
|
2-(alpha-L-Rhamnopyranosyloxy)-3-methoxy-5-(hydroxymethyl)-7H-dibenzo[a,c]cycloheptene-9-ol
|
102345053 |
Click to see
CC1C(C(C(C(O1)OC2=C(C=C3C(=CCC4=C(C3=C2)C=CC(=C4)O)CO)OC)O)O)O
|
430.40 |
unknown |
via CMAUP database |
2,4,6-Trihydroxy1butyrophenone 2-O-beta-D-glucopyranoside
|
51357548 |
Click to see
CCCC(=O)C1=C(C=C(C=C1OC2C(C(C(C(O2)CO)O)O)O)O)O
|
358.34 |
unknown |
via CMAUP database |
Furcatin
|
442789 |
Click to see
C=CCC1=CC=C(C=C1)OC2C(C(C(C(O2)COC3C(C(CO3)(CO)O)O)O)O)O
|
428.40 |
unknown |
via CMAUP database |
Subavenoside D
|
71461984 |
Click to see
COC1=C(C=C2C3=CC=CC=C3CC=C(C2=C1)CO)OC4C(C(C(C(O4)CO)O)O)O
|
430.40 |
unknown |
via CMAUP database |
Subavenoside E
|
71451248 |
Click to see
COCC1=CCC2=C(C=CC(=C2)OC)C3=CC(=C(C=C13)OC)OC4C(C(C(C(O4)CO)O)O)O
|
474.50 |
unknown |
via CMAUP database |
> Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Benzaldehydes / Hydroxybenzaldehydes
|
4-Hydroxybenzaldehyde
|
126 |
Click to see
C1=CC(=CC=C1C=O)O
|
122.12 |
unknown |
via CMAUP database |
> Organic oxygen compounds / Organooxygen compounds / Carbonyl compounds / Cyclic ketones / Cyclohexenones
|
Oxyphyllenodiol A
|
10082923 |
Click to see
CC(C)C1CCC(=O)C2=C1C(C(CC2)(C)O)O
|
238.32 |
unknown |
via CMAUP database |
Oxyphyllenodiol B
|
5279294 |
Click to see
CC(C)C1CCC(=O)C2=C1C(C(CC2)(C)O)O
|
238.32 |
unknown |
via CMAUP database |
> Organic oxygen compounds / Organooxygen compounds / Ethers / Acetals / Ketals
|
Subamolide A
|
16104909 |
Click to see
CCCCCCCCCCCCCC=C1C(C(OC1=O)(C)OC)O
|
340.50 |
unknown |
via CMAUP database |
Subamolide B
|
16104907 |
Click to see
CCCCCCCCCCCCCC=C1C(C(OC1=O)(C)OC)O
|
340.50 |
unknown |
via CMAUP database |
> Organoheterocyclic compounds / Benzodioxoles
|
Myristicin
|
4276 |
Click to see
COC1=CC(=CC2=C1OCO2)CC=C
|
192.21 |
unknown |
via CMAUP database |
> Organoheterocyclic compounds / Dihydrofurans / Furanones / Butenolides
|
(4E,7E,10S)-5,9,9-Trimethyl-11-oxabicyclo[8.2.1]trideca-1(13),4,7-triene-6,12-dione
|
13919627 |
Click to see
CC1=CCCC2=CC(C(C=CC1=O)(C)C)OC2=O
|
246.30 |
unknown |
https://doi.org/10.1016/S0040-4020(01)91476-0 |
(4Z,7E)-5,9,9-trimethyl-11-oxabicyclo[8.2.1]trideca-1(13),4,7-triene-6,12-dione
|
21725258 |
Click to see
CC1=CCCC2=CC(C(C=CC1=O)(C)C)OC2=O
|
246.30 |
unknown |
https://doi.org/10.1016/S0040-4020(01)91476-0 |
Asteriscunolide A
|
13919624 |
Click to see
CC1=CCCC2=CC(C(C=CC1=O)(C)C)OC2=O
|
246.30 |
unknown |
https://doi.org/10.1016/S0040-4020(01)91476-0 |
Asteriscunolide B
|
13919625 |
Click to see
CC1=CCCC2=CC(C(C=CC1=O)(C)C)OC2=O
|
246.30 |
unknown |
https://doi.org/10.1016/S0040-4020(01)91476-0 |
> Organoheterocyclic compounds / Lactones / Gamma butyrolactones
|
(1S,4S,7S,9Z)-5,5,9-trimethyl-3-oxatetracyclo[5.5.1.01,6.04,13]tridec-9-ene-2,8-dione
|
132584645 |
Click to see
CC1=CCCC23C4C(C2C(C4OC3=O)(C)C)C1=O
|
246.30 |
unknown |
https://doi.org/10.1016/S0040-4039(00)99142-1 |
5,5,9-Trimethyl-3-oxatricyclo[5.5.1.04,13]tridecane-2,8-dione
|
73115665 |
Click to see
CC1CCCC2C3C(C1=O)CC(C3OC2=O)(C)C
|
250.33 |
unknown |
https://doi.org/10.1016/S0040-4039(00)95101-3 |
> Organoheterocyclic compounds / Oxolanes
|
(4R)-3-[(E)-Undecylidene]-4beta-hydroxy-5-methylenetetrahydrofuran-2-one
|
24757906 |
Click to see
CCCCCCCCCCC=C1C(C(=C)OC1=O)O
|
266.38 |
unknown |
via CMAUP database |
Isolinderanolide B
|
53308122 |
Click to see
CCCCCCCCCCCCCC=C1C(C(=C)OC1=O)O
|
308.50 |
unknown |
via CMAUP database |
Isooblusilactonc A
|
6442493 |
Click to see
CCCCCCCCCCCCCC=C1C(C(=C)OC1=O)O
|
308.50 |
unknown |
via CMAUP database |
Obtusilactone A
|
6442492 |
Click to see
CCCCCCCCCCCCCC=C1C(C(=C)OC1=O)O
|
308.50 |
unknown |
via CMAUP database |
Subamolide D
|
24757907 |
Click to see
CCCCCCCCCCC=C1C(C(=C)OC1=O)O
|
266.38 |
unknown |
via CMAUP database |
> Phenylpropanoids and polyketides / 2-arylbenzofuran flavonoids
|
[[(2R,3R)-2,3-Dihydro-2-(4-hydroxy-3-methoxyphenyl)-5-(3-hydroxypropyl)-7-methoxybenzofuran-3-yl]methyl]beta-D-glucopyranoside
|
95223221 |
Click to see
COC1=CC(=CC2=C1OC(C2COC3C(C(C(C(O3)CO)O)O)O)C4=CC(=C(C=C4)O)OC)CCCO
|
522.50 |
unknown |
via CMAUP database |
> Phenylpropanoids and polyketides / Cinnamic acids and derivatives / Hydroxycinnamic acids and derivatives / Hydroxycinnamic acids
|
Ferulic acid
|
445858 |
Click to see
COC1=C(C=CC(=C1)C=CC(=O)O)O
|
194.18 |
unknown |
via CMAUP database |
> Phenylpropanoids and polyketides / Cinnamyl alcohols
|
3,4-Methylenedioxy-5-methoxycinnamyl alcohol
|
85441832 |
Click to see
COC1=CC(=CC2=C1OCO2)C=CCO
|
208.21 |
unknown |
via CMAUP database |
> Phenylpropanoids and polyketides / Flavonoids / Biflavonoids and polyflavonoids
|
Aescultitannin B
|
10010849 |
Click to see
C1C(C(OC2=C1C(=CC(=C2C3C(C(OC4=C3C(=CC5=C4C6C(C(O5)(OC7=CC(=CC(=C67)O)O)C8=CC(=C(C=C8)O)O)O)O)C9=CC(=C(C=C9)O)O)O)O)O)C1=CC(=C(C=C1)O)O)O
|
864.80 |
unknown |
via CMAUP database |
Cinnamtannin D1
|
46173958 |
Click to see
C1C(C(OC2=C1C(=CC(=C2C3C(C(OC4=C3C(=CC5=C4C6C(C(O5)(OC7=CC(=CC(=C67)O)O)C8=CC(=C(C=C8)O)O)O)O)C9=CC(=C(C=C9)O)O)O)O)O)C1=CC(=C(C=C1)O)O)O
|
864.80 |
unknown |
via CMAUP database |
> Phenylpropanoids and polyketides / Flavonoids / Flavans / Catechins
|
Cianidanol
|
9064 |
Click to see
C1C(C(OC2=CC(=CC(=C21)O)O)C3=CC(=C(C=C3)O)O)O
|
290.27 |
unknown |
via CMAUP database |
Epicatechin
|
72276 |
Click to see
C1C(C(OC2=CC(=CC(=C21)O)O)C3=CC(=C(C=C3)O)O)O
|
290.27 |
unknown |
via CMAUP database |
> Phenylpropanoids and polyketides / Flavonoids / Flavonoid glycosides / Flavonoid O-glycosides
|
(2R)-7-hydroxy-2-(4-hydroxyphenyl)-5-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2,3-dihydrochromen-4-one
|
3083618 |
Click to see
C1C(OC2=C(C1=O)C(=CC(=C2)O)OC3C(C(C(C(O3)CO)O)O)O)C4=CC=C(C=C4)O
|
434.40 |
unknown |
via CMAUP database |
Helichrysin A
|
15559669 |
Click to see
C1C(OC2=C(C1=O)C(=CC(=C2)O)OC3C(C(C(C(O3)CO)O)O)O)C4=CC=C(C=C4)O
|
434.40 |
unknown |
via CMAUP database |
Phlorizin
|
6072 |
Click to see
C1=CC(=CC=C1CCC(=O)C2=C(C=C(C=C2OC3C(C(C(C(O3)CO)O)O)O)O)O)O
|
436.40 |
unknown |
via CMAUP database |
> Phenylpropanoids and polyketides / Flavonoids / Flavonoid glycosides / Flavonoid O-glycosides / Flavonoid-3-O-glycosides
|
Afzelin
|
5316673 |
Click to see
CC1C(C(C(C(O1)OC2=C(OC3=CC(=CC(=C3C2=O)O)O)C4=CC=C(C=C4)O)O)O)O
|
432.40 |
unknown |
via CMAUP database |
Astragalin
|
5282102 |
Click to see
C1=CC(=CC=C1C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)OC4C(C(C(C(O4)CO)O)O)O)O
|
448.40 |
unknown |
via CMAUP database |
Kaempferol-3-O-rutinoside
|
5318767 |
Click to see
CC1C(C(C(C(O1)OCC2C(C(C(C(O2)OC3=C(OC4=CC(=CC(=C4C3=O)O)O)C5=CC=C(C=C5)O)O)O)O)O)O)O
|
594.50 |
unknown |
via CMAUP database |
> Phenylpropanoids and polyketides / Flavonoids / Flavonoid glycosides / Flavonoid O-glycosides / Flavonoid-7-O-glycosides
|
Prunin
|
92794 |
Click to see
C1C(OC2=CC(=CC(=C2C1=O)O)OC3C(C(C(C(O3)CO)O)O)O)C4=CC=C(C=C4)O
|
434.40 |
unknown |
via CMAUP database |