> Benzenoids / Benzene and substituted derivatives / Benzoic acids and derivatives / Hydroxybenzoic acid derivatives / Gallic acid and derivatives / Gallic acids
|
Gallic Acid
|
370 |
Click to see
C1=C(C=C(C(=C1O)O)O)C(=O)O
|
170.12 |
unknown |
via CMAUP database |
> Benzenoids / Benzene and substituted derivatives / Benzoyl derivatives
|
Benzaldehyde
|
240 |
Click to see
C1=CC=C(C=C1)C=O
|
106.12 |
unknown |
via CMAUP database |
> Benzenoids / Benzene and substituted derivatives / Benzylethers
|
1,4-Bis(Methoxymethyl)Benzene
|
81239 |
Click to see
COCC1=CC=C(C=C1)COC
|
166.22 |
unknown |
via CMAUP database |
> Benzenoids / Benzene and substituted derivatives / Diphenylethers
|
Dehydrodigallic acid
|
14057208 |
Click to see
C1=C(C=C(C(=C1O)O)OC2=C(C(=C(C=C2C(=O)O)O)O)O)C(=O)O
|
338.22 |
unknown |
via CMAUP database |
> Benzenoids / Naphthalenes
|
2-(111C)methylnaphthalene
|
450699 |
Click to see
CC1=CC2=CC=CC=C2C=C1
|
141.20 |
unknown |
via CMAUP database |
> Benzenoids / Phenols / Tyrosols and derivatives / Tyrosols
|
Hydroxytyrosol
|
82755 |
Click to see
C1=CC(=C(C=C1CCO)O)O
|
154.16 |
unknown |
https://doi.org/10.1007/BF00629789 |
Tyrosol
|
10393 |
Click to see
C1=CC(=CC=C1CCO)O
|
138.16 |
unknown |
https://doi.org/10.1016/S0031-9422(00)94288-2 https://doi.org/10.1007/BF00629789 https://doi.org/10.1007/BF00597667 |
> Hydrocarbons / Saturated hydrocarbons
|
CID 172416
|
172416 |
Click to see
CCCCCCCCCCCCCCC[CH2]
|
225.43 |
unknown |
via CMAUP database |
> Hydrocarbons / Saturated hydrocarbons / Alkanes
|
(111C)pentadecane
|
450704 |
Click to see
CCCCCCCCCCCCCCC
|
211.42 |
unknown |
via CMAUP database |
Heptadecane
|
12398 |
Click to see
CCCCCCCCCCCCCCCCC
|
240.50 |
unknown |
via CMAUP database |
> Hydrocarbons / Unsaturated hydrocarbons / Branched unsaturated hydrocarbons
|
1,3-Cyclopentadiene, 5,5-dimethyl-2-propyl-
|
572123 |
Click to see
CCCC1=CC(C=C1)(C)C
|
136.23 |
unknown |
via CMAUP database |
Octatriene, dimethyl-
|
6434062 |
Click to see
CC(C)C=CC=C(C)C=C
|
136.23 |
unknown |
via CMAUP database |
> Hydrocarbons / Unsaturated hydrocarbons / Unsaturated aliphatic hydrocarbons
|
1-Tetradecene
|
14260 |
Click to see
CCCCCCCCCCCCC=C
|
196.37 |
unknown |
via CMAUP database |
> Lignans, neolignans and related compounds / Furanoid lignans
|
Syringaresinol
|
100067 |
Click to see
COC1=CC(=CC(=C1O)OC)C2C3COC(C3CO2)C4=CC(=C(C(=C4)OC)O)OC
|
418.40 |
unknown |
https://www.ncbi.nlm.nih.gov/pmc/articles/PMC5157019/ https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3317483/ https://doi.org/10.1016/J.BMCL.2014.11.045 https://doi.org/10.1016/J.BMCL.2016.07.001 https://doi.org/10.1248/BPB.25.791 |
> Lignans, neolignans and related compounds / Lignan glycosides
|
2-[4-[[3-Hydroxy-5-(4-hydroxy-3-methoxyphenyl)-4-(hydroxymethyl)oxolan-3-yl]methyl]-2-methoxyphenoxy]-6-(hydroxymethyl)oxane-3,4,5-triol
|
14033814 |
Click to see
COC1=C(C=CC(=C1)CC2(COC(C2CO)C3=CC(=C(C=C3)O)OC)O)OC4C(C(C(C(O4)CO)O)O)O
|
538.50 |
unknown |
https://doi.org/10.1007/BF00629924 |
Lariciresinol 4-O-beta-D-glucopyranoside
|
73157776 |
Click to see
COC1=C(C=CC(=C1)CC2COC(C2CO)C3=CC(=C(C=C3)O)OC)OC4C(C(C(C(O4)CO)O)O)O
|
522.50 |
unknown |
https://doi.org/10.1007/BF00629924 |
lariciresinol 4-O-glucoside
|
11972394 |
Click to see
COC1=C(C=CC(=C1)CC2COC(C2CO)C3=CC(=C(C=C3)O)OC)OC4C(C(C(C(O4)CO)O)O)O
|
522.50 |
unknown |
https://doi.org/10.1007/BF00629924 |
Olivil 4'-O-glucoside
|
14033815 |
Click to see
COC1=C(C=CC(=C1)CC2(COC(C2CO)C3=CC(=C(C=C3)O)OC)O)OC4C(C(C(C(O4)CO)O)O)O
|
538.50 |
unknown |
https://doi.org/10.1007/BF00629924 |
> Lipids and lipid-like molecules / Fatty Acyls / Fatty acid esters
|
cis-3-HEXENYLVALERATE
|
92573 |
Click to see
CCCCC(=O)OCCC=CCC
|
184.27 |
unknown |
via CMAUP database |
> Lipids and lipid-like molecules / Prenol lipids / Monoterpenoids / Acyclic monoterpenoids
|
2,6-Dimethyl-2,4,6-octatriene
|
5368821 |
Click to see
CC=C(C)C=CC=C(C)C
|
136.23 |
unknown |
via CMAUP database |
> Lipids and lipid-like molecules / Prenol lipids / Monoterpenoids / Menthane monoterpenoids
|
Terpinolene
|
11463 |
Click to see
CC1=CCC(=C(C)C)CC1
|
136.23 |
unknown |
via CMAUP database |
> Lipids and lipid-like molecules / Prenol lipids / Terpene glycosides
|
(-)-Oleoside 11-methyl ester
|
131753164 |
Click to see
CC=C1C(C(=COC1OC2C(C(C(C(O2)CO)O)O)O)C(=O)OC)CC(=O)O
|
404.40 |
unknown |
https://doi.org/10.1016/0031-9422(95)00210-X |
(5Z)-4-[2-[2-(3,4-dihydroxyphenyl)ethoxy]-2-oxoethyl]-5-ethylidene-6-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4H-pyran-3-carboxylic acid
|
89887620 |
Click to see
CC=C1C(C(=COC1OC2C(C(C(C(O2)CO)O)O)O)C(=O)O)CC(=O)OCCC3=CC(=C(C=C3)O)O
|
526.50 |
unknown |
https://doi.org/10.1007/BF00601302 |
(Z)-methyl 4-(2-(3,4-dihydroxyphenethoxy)-2-oxoethyl)-3-ethylidene-2-((2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yloxy)-3,4-dihydro-2H-pyran-5-carboxylate
|
134688908 |
Click to see
CC=C1C(C(=COC1OC2C(C(C(C(O2)CO)O)O)O)C(=O)OC)CC(=O)OCCC3=CC(=C(C=C3)O)O
|
540.50 |
unknown |
https://doi.org/10.1007/BF00629789 https://doi.org/10.1007/BF00601302 |
2-(3,4-dihydroxyphenyl)ethyl (4S,5E,6S)-4-[2-[2-(3,4-dihydroxyphenyl)ethoxy]-2-oxoethyl]-5-ethylidene-6-[(2S,3S,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4H-pyran-3-carboxylate
|
162873754 |
Click to see
CC=C1C(C(=COC1OC2C(C(C(C(O2)CO)O)O)O)C(=O)OCCC3=CC(=C(C=C3)O)O)CC(=O)OCCC4=CC(=C(C=C4)O)O
|
662.60 |
unknown |
https://doi.org/10.1248/YAKUSHI1947.107.3_245 |
2-(4-hydroxyphenyl)ethyl (4S,5E,6S)-5-ethylidene-4-(2-methoxy-2-oxoethyl)-6-[(2S,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4H-pyran-3-carboxylate
|
162978206 |
Click to see
CC=C1C(C(=COC1OC2C(C(C(C(O2)CO)O)O)O)C(=O)OCCC3=CC=C(C=C3)O)CC(=O)OC
|
524.50 |
unknown |
https://doi.org/10.1248/YAKUSHI1947.107.3_245 |
2-[3-ethylidene-5-methoxycarbonyl-2-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4H-pyran-4-yl]acetic acid
|
74256813 |
Click to see
CC=C1C(C(=COC1OC2C(C(C(C(O2)CO)O)O)O)C(=O)OC)CC(=O)O
|
404.40 |
unknown |
https://doi.org/10.1016/0031-9422(95)00210-X |
2H-Pyran-4-acetic acid, 3-ethylidene-2-(beta-D-glucopyranosyloxy)-3,4-dihydro-5-(methoxycarbonyl)-, 2-(4-hydroxyphenyl)ethyl ester, [2S-(2alpha,3E,4beta)]-; Ligstroside
|
72727933 |
Click to see
CC=C1C(C(=COC1OC2C(C(C(C(O2)CO)O)O)O)C(=O)OC)CC(=O)OCCC3=CC=C(C=C3)O
|
524.50 |
unknown |
https://doi.org/10.1007/S11418-008-0295-3 https://doi.org/10.1007/BF00601302 |
Demethyloleuropein
|
6450302 |
Click to see
CC=C1C(C(=COC1OC2C(C(C(C(O2)CO)O)O)O)C(=O)O)CC(=O)OCCC3=CC(=C(C=C3)O)O
|
526.50 |
unknown |
https://doi.org/10.1007/BF00601302 |
Isoligustroside
|
6442863 |
Click to see
CC=C1C(C(=COC1OC2C(C(C(C(O2)CO)O)O)O)C(=O)OCCC3=CC=C(C=C3)O)CC(=O)OC
|
524.50 |
unknown |
https://doi.org/10.1248/YAKUSHI1947.107.3_245 |
Isooleuropein
|
6442862 |
Click to see
CC=C1C(C(=COC1OC2C(C(C(C(O2)CO)O)O)O)C(=O)OCCC3=CC(=C(C=C3)O)O)CC(=O)OC
|
540.50 |
unknown |
https://doi.org/10.1248/YAKUSHI1947.107.3_245 |
Ligstroside
|
14136859 |
Click to see
CC=C1C(C(=COC1OC2C(C(C(C(O2)CO)O)O)O)C(=O)OC)CC(=O)OCCC3=CC=C(C=C3)O
|
524.50 |
unknown |
https://doi.org/10.1007/BF00601302 https://doi.org/10.1007/S11418-008-0295-3 |
methyl (4S,5E,6R)-5-ethylidene-4-[2-[2-(4-hydroxyphenyl)ethoxy]-2-oxoethyl]-6-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4H-pyran-3-carboxylate
|
75492723 |
Click to see
CC=C1C(C(=COC1OC2C(C(C(C(O2)CO)O)O)O)C(=O)OC)CC(=O)OCCC3=CC=C(C=C3)O
|
524.50 |
unknown |
https://doi.org/10.1007/BF00629789 https://doi.org/10.1007/BF00601302 |
methyl (4S,5E,6S)-5-ethylidene-4-(2-methoxy-2-oxoethyl)-6-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4H-pyran-3-carboxylate
|
10788149 |
Click to see
CC=C1C(C(=COC1OC2C(C(C(C(O2)CO)O)O)O)C(=O)OC)CC(=O)OC
|
418.40 |
unknown |
https://doi.org/10.1016/0031-9422(95)00210-X |
methyl (4S,5E,6S)-5-ethylidene-4-[2-[2-(4-hydroxyphenyl)ethoxy]-2-oxoethyl]-6-[(2S,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4H-pyran-3-carboxylate
|
162947192 |
Click to see
CC=C1C(C(=COC1OC2C(C(C(C(O2)CO)O)O)O)C(=O)OC)CC(=O)OCCC3=CC=C(C=C3)O
|
524.50 |
unknown |
https://doi.org/10.1016/S0031-9422(00)94288-2 |
methyl (4S,5Z,6S)-5-ethylidene-4-[2-oxo-2-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyethyl]-6-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4H-pyran-3-carboxylate
|
14080694 |
Click to see
CC=C1C(C(=COC1OC2C(C(C(C(O2)CO)O)O)O)C(=O)OC)CC(=O)OC3C(C(C(C(O3)CO)O)O)O
|
566.50 |
unknown |
https://doi.org/10.1248/YAKUSHI1947.108.4_355 |
methyl 4-[2-[2-(3,4-dihydroxyphenyl)ethoxy]-2-oxoethyl]-5-ethylidene-6-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4H-pyran-3-carboxylate
|
3789874 |
Click to see
CC=C1C(C(=COC1OC2C(C(C(C(O2)CO)O)O)O)C(=O)OC)CC(=O)OCCC3=CC(=C(C=C3)O)O
|
540.50 |
unknown |
https://doi.org/10.1016/0031-9422(95)00210-X https://doi.org/10.1007/S11418-008-0295-3 https://doi.org/10.1007/BF00601302 |
methyl 5-ethylidene-4-(2-methoxy-2-oxoethyl)-6-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4H-pyran-3-carboxylate
|
72726525 |
Click to see
CC=C1C(C(=COC1OC2C(C(C(C(O2)CO)O)O)O)C(=O)OC)CC(=O)OC
|
418.40 |
unknown |
https://doi.org/10.1016/0031-9422(95)00210-X |
Neooleuropein
|
6442861 |
Click to see
CC=C1C(C(=COC1OC2C(C(C(C(O2)CO)O)O)O)C(=O)OCCC3=CC(=C(C=C3)O)O)CC(=O)OCCC4=CC(=C(C=C4)O)O
|
662.60 |
unknown |
https://doi.org/10.1248/YAKUSHI1947.107.3_245 |
Oleoside 11-Methyl Ester
|
10692563 |
Click to see
CC=C1C(C(=COC1OC2C(C(C(C(O2)CO)O)O)O)C(=O)OC)CC(=O)O
|
404.40 |
unknown |
https://doi.org/10.1016/0031-9422(95)00210-X |
Oleuropein
|
5281544 |
Click to see
CC=C1C(C(=COC1OC2C(C(C(C(O2)CO)O)O)O)C(=O)OC)CC(=O)OCCC3=CC(=C(C=C3)O)O
|
540.50 |
unknown |
https://doi.org/10.1016/0031-9422(95)00210-X https://doi.org/10.1016/S0031-9422(00)94288-2 https://doi.org/10.1007/S11418-008-0295-3 https://doi.org/10.1007/BF00601302 |
Secologanoside
|
14136854 |
Click to see
C=CC1C(C(=COC1OC2C(C(C(C(O2)CO)O)O)O)C(=O)O)CC(=O)O
|
390.34 |
unknown |
https://doi.org/10.1016/0031-9422(95)00210-X |
Secologanoside 7-methyl ester
|
14136853 |
Click to see
C=CC1C(C(=COC1OC2C(C(C(C(O2)CO)O)O)O)C(=O)O)CC(=O)O
|
390.34 |
unknown |
https://doi.org/10.1016/0031-9422(95)00210-X |
> Lipids and lipid-like molecules / Saccharolipids
|
methyl 5-ethylidene-4-[2-oxo-2-[[3,4,5-trihydroxy-6-[2-(4-hydroxyphenyl)ethoxy]oxan-2-yl]methoxy]ethyl]-6-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4H-pyran-3-carboxylate
|
72987608 |
Click to see
CC=C1C(C(=COC1OC2C(C(C(C(O2)CO)O)O)O)C(=O)OC)CC(=O)OCC3C(C(C(C(O3)OCCC4=CC=C(C=C4)O)O)O)O
|
686.70 |
unknown |
https://doi.org/10.1007/BF00601302 |
Nuezhenide
|
6440999 |
Click to see
CC=C1C(C(=COC1OC2C(C(C(C(O2)CO)O)O)O)C(=O)OC)CC(=O)OCC3C(C(C(C(O3)OCCC4=CC=C(C=C4)O)O)O)O
|
686.70 |
unknown |
https://doi.org/10.1007/BF00601302 https://doi.org/10.1007/BF00629789 |
Specnuezhenide
|
91895359 |
Click to see
CC=C1C(C(=COC1OC2C(C(C(C(O2)CO)O)O)O)C(=O)OC)CC(=O)OCC3C(C(C(C(O3)OCCC4=CC=C(C=C4)O)O)O)O
|
686.70 |
unknown |
https://doi.org/10.1007/BF00601302 |
> Organic oxygen compounds / Organooxygen compounds / Carbohydrates and carbohydrate conjugates / Glycosyl compounds / O-glycosyl compounds
|
(1R,4aS,8S,8aS)-1-methyl-3-oxo-8-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4,4a,8,8a-tetrahydro-1H-pyrano[3,4-c]pyran-5-carboxylic acid
|
95224052 |
Click to see
CC1C2C(CC(=O)O1)C(=COC2OC3C(C(C(C(O3)CO)O)O)O)C(=O)O
|
390.34 |
unknown |
https://doi.org/10.1016/0031-9422(95)00210-X |
1-methyl-3-oxo-8-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4,4a,8,8a-tetrahydro-1H-pyrano[3,4-c]pyran-5-carboxylic acid
|
56776284 |
Click to see
CC1C2C(CC(=O)O1)C(=COC2OC3C(C(C(C(O3)CO)O)O)O)C(=O)O
|
390.34 |
unknown |
https://doi.org/10.1016/0031-9422(95)00210-X |
2-(3,4-dihydroxyphenyl)ethyl (1R,4aS,8S,8aS)-1-methyl-3-oxo-8-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4,4a,8,8a-tetrahydro-1H-pyrano[3,4-c]pyran-5-carboxylate
|
21593827 |
Click to see
CC1C2C(CC(=O)O1)C(=COC2OC3C(C(C(C(O3)CO)O)O)O)C(=O)OCCC4=CC(=C(C=C4)O)O
|
526.50 |
unknown |
https://doi.org/10.1016/0031-9422(95)00210-X |
2-(3,4-dihydroxyphenyl)ethyl 1-methyl-3-oxo-8-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4,4a,8,8a-tetrahydro-1H-pyrano[3,4-c]pyran-5-carboxylate
|
73810066 |
Click to see
CC1C2C(CC(=O)O1)C(=COC2OC3C(C(C(C(O3)CO)O)O)O)C(=O)OCCC4=CC(=C(C=C4)O)O
|
526.50 |
unknown |
https://doi.org/10.1016/0031-9422(95)00210-X |
2-(4-hydroxyphenyl)ethyl (1R,4aS,8S,8aS)-1-methyl-3-oxo-8-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4,4a,8,8a-tetrahydro-1H-pyrano[3,4-c]pyran-5-carboxylate
|
21593826 |
Click to see
CC1C2C(CC(=O)O1)C(=COC2OC3C(C(C(C(O3)CO)O)O)O)C(=O)OCCC4=CC=C(C=C4)O
|
510.50 |
unknown |
https://doi.org/10.1016/0031-9422(95)00210-X |
2-(4-hydroxyphenyl)ethyl 1-methyl-3-oxo-8-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4,4a,8,8a-tetrahydro-1H-pyrano[3,4-c]pyran-5-carboxylate
|
14080684 |
Click to see
CC1C2C(CC(=O)O1)C(=COC2OC3C(C(C(C(O3)CO)O)O)O)C(=O)OCCC4=CC=C(C=C4)O
|
510.50 |
unknown |
https://doi.org/10.1016/0031-9422(95)00210-X |
methyl (1R,4aS,8S,8aS)-1-methyl-3-oxo-8-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4,4a,8,8a-tetrahydro-1H-pyrano[3,4-c]pyran-5-carboxylate
|
12304886 |
Click to see
CC1C2C(CC(=O)O1)C(=COC2OC3C(C(C(C(O3)CO)O)O)O)C(=O)OC
|
404.40 |
unknown |
https://doi.org/10.1016/0031-9422(95)00210-X https://doi.org/10.1248/YAKUSHI1947.108.4_355 |
methyl 1-methyl-3-oxo-8-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4,4a,8,8a-tetrahydro-1H-pyrano[3,4-c]pyran-5-carboxylate
|
12304883 |
Click to see
CC1C2C(CC(=O)O1)C(=COC2OC3C(C(C(C(O3)CO)O)O)O)C(=O)OC
|
404.40 |
unknown |
https://doi.org/10.1016/0031-9422(95)00210-X |
Salidroside
|
159278 |
Click to see
C1=CC(=CC=C1CCOC2C(C(C(C(O2)CO)O)O)O)O
|
300.30 |
unknown |
https://doi.org/10.1007/BF00597667 https://doi.org/10.1007/BF00629789 https://doi.org/10.1016/0031-9422(83)80018-1 |
> Organic oxygen compounds / Organooxygen compounds / Carbohydrates and carbohydrate conjugates / Glycosyl compounds / Phenolic glycosides
|
2-(Hydroxymethyl)-6-[4-(3-hydroxyprop-1-enyl)-2-methoxyphenoxy]oxane-3,4,5-triol
|
3496897 |
Click to see
COC1=C(C=CC(=C1)C=CCO)OC2C(C(C(C(O2)CO)O)O)O
|
342.34 |
unknown |
https://doi.org/10.1007/BF00629789 |
2-(Hydroxymethyl)-6-[4-(3-hydroxyprop-1-enyl)-2,6-dimethoxyphenoxy]oxane-3,4,5-triol
|
323959 |
Click to see
COC1=CC(=CC(=C1OC2C(C(C(C(O2)CO)O)O)O)OC)C=CCO
|
372.40 |
unknown |
https://doi.org/10.1007/BF00629789 |
Coniferin
|
5280372 |
Click to see
COC1=C(C=CC(=C1)C=CCO)OC2C(C(C(C(O2)CO)O)O)O
|
342.34 |
unknown |
https://doi.org/10.1007/BF00629789 https://doi.org/10.1007/BF00597667 |
Eleutheroside B
|
5316860 |
Click to see
COC1=CC(=CC(=C1OC2C(C(C(C(O2)CO)O)O)O)OC)C=CCO
|
372.40 |
unknown |
https://doi.org/10.1002/PTR.2650090614 https://doi.org/10.1007/BF00629789 https://doi.org/10.1007/BF00597667 |
> Organoheterocyclic compounds / Azolines / Oxazolines
|
1-[(1R,6R)-5-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-6-ethenyl-2-methoxy-1-methylcyclohexa-2,4-dien-1-yl]pent-4-en-1-one
|
101395154 |
Click to see
CC1(COC(=N1)C2=CC=C(C(C2C=C)(C)C(=O)CCC=C)OC)C
|
329.40 |
unknown |
via CMAUP database |
> Organoheterocyclic compounds / Diazanaphthalenes / Naphthyridines
|
1-methyl-2,4-dihydro-1H-2,7-naphthyridin-3-one
|
21763825 |
Click to see
CC1C2=C(CC(=O)N1)C=CN=C2
|
162.19 |
unknown |
https://doi.org/10.1016/S0031-9422(00)94288-2 |
Jasminidine
|
101409962 |
Click to see
CC1C2=C(CC(=O)N1)C=CN=C2
|
162.19 |
unknown |
https://doi.org/10.1016/S0031-9422(00)94288-2 |
> Organoheterocyclic compounds / Diazanaphthalenes / Naphthyridines / Naphthyridine carboxylic acids and derivatives
|
methyl (8R)-8-methyl-6-oxo-7,8-dihydro-5H-2,7-naphthyridine-4-carboxylate
|
159227592 |
Click to see
CC1C2=CN=CC(=C2CC(=O)N1)C(=O)OC
|
220.22 |
unknown |
https://doi.org/10.1016/S0031-9422(00)94288-2 |
methyl 8-methyl-6-oxo-7,8-dihydro-5H-2,7-naphthyridine-4-carboxylate
|
3536738 |
Click to see
CC1C2=CN=CC(=C2CC(=O)N1)C(=O)OC
|
220.22 |
unknown |
https://doi.org/10.1016/S0031-9422(00)94288-2 |
> Phenylpropanoids and polyketides / Cinnamic acids and derivatives / Hydroxycinnamic acids and derivatives / Coumaric acids and derivatives
|
2-(3,4-Dihydroxyphenyl)ethyl 3-O-(6-Deoxy-alpha-L-mannopyranosyl)-4-O-[(2E)-3-(3,4-dihydroxyphenyl)-2-propenoyl]-beta-D-glucopyranoside
|
132274946 |
Click to see
CC1C(C(C(C(O1)OC2C(C(OC(C2OC(=O)C=CC3=CC(=C(C=C3)O)O)CO)OCCC4=CC(=C(C=C4)O)O)O)O)O)O
|
624.60 |
unknown |
https://doi.org/10.1002/PTR.2650090713 https://doi.org/10.1007/BF00597667 https://doi.org/10.1016/0031-9422(83)80018-1 https://doi.org/10.1055/S-2008-1074499 https://doi.org/10.1007/BF00629789 |
Forsythiaside
|
5281773 |
Click to see
CC1C(C(C(C(O1)OCC2C(C(C(C(O2)OCCC3=CC(=C(C=C3)O)O)O)O)OC(=O)C=CC4=CC(=C(C=C4)O)O)O)O)O
|
624.60 |
unknown |
https://doi.org/10.1007/BF00629789 https://doi.org/10.1007/BF00597667 |
Verbascoside
|
5281800 |
Click to see
CC1C(C(C(C(O1)OC2C(C(OC(C2OC(=O)C=CC3=CC(=C(C=C3)O)O)CO)OCCC4=CC(=C(C=C4)O)O)O)O)O)O
|
624.60 |
unknown |
https://doi.org/10.1002/PTR.2650090713 https://doi.org/10.1007/BF00597667 https://doi.org/10.1016/0031-9422(83)80018-1 https://doi.org/10.1055/S-2008-1074499 https://doi.org/10.1007/BF00629789 |
> Phenylpropanoids and polyketides / Cinnamic acids and derivatives / Hydroxycinnamic acids and derivatives / Hydroxycinnamic acid esters / Coumaric acid esters
|
[(2R,3R,4R,5R,6R)-4-[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy-5-hydroxy-2-[[(1S,2S,4S,5S,6S,10S)-2-(hydroxymethyl)-10-[(2S,3S,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,9-dioxatricyclo[4.4.0.02,4]dec-7-en-5-yl]oxy]-6-methyloxan-3-yl] (E)-3-(4-hydroxyphenyl)prop-2-enoate
|
162821200 |
Click to see
CC1C(C(C(C(O1)OC2C3C=COC(C3C4(C2O4)CO)OC5C(C(C(C(O5)CO)O)O)O)OC(=O)C=CC6=CC=C(C=C6)O)OC(=O)C=CC7=CC(=C(C=C7)O)O)O
|
816.80 |
unknown |
https://doi.org/10.1007/BF00601302 |
> Phenylpropanoids and polyketides / Coumarins and derivatives / Hydroxycoumarins
|
Isoscopoletin
|
69894 |
Click to see
COC1=C(C=C2C=CC(=O)OC2=C1)O
|
192.17 |
unknown |
via CMAUP database |
> Phenylpropanoids and polyketides / Coumarins and derivatives / Hydroxycoumarins / 6,7-dihydroxycoumarins
|
Esculetin
|
5281416 |
Click to see
C1=CC(=O)OC2=CC(=C(C=C21)O)O
|
178.14 |
unknown |
https://doi.org/10.1007/BF00597667 |
> Phenylpropanoids and polyketides / Flavonoids / Flavones
|
Kaempferol 3,7-di-O-sulfate
|
12988285 |
Click to see
C1=CC(=CC=C1C2=C(C(=O)C3=C(C=C(C=C3O2)OS(=O)(=O)O)O)OS(=O)(=O)O)O
|
446.40 |
unknown |
via CMAUP database |
> Phenylpropanoids and polyketides / Flavonoids / Flavones / Flavonols
|
Kaempferol
|
5280863 |
Click to see
C1=CC(=CC=C1C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)O)O
|
286.24 |
unknown |
via CMAUP database |
Quercetin
|
5280343 |
Click to see
C1=CC(=C(C=C1C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)O)O)O
|
302.23 |
unknown |
via CMAUP database |
Tamarixetin
|
5281699 |
Click to see
COC1=C(C=C(C=C1)C2=C(C(=O)C3=C(C=C(C=C3O2)O)O)O)O
|
316.26 |
unknown |
via CMAUP database |
> Phenylpropanoids and polyketides / Flavonoids / Flavonoid glycosides / Flavonoid O-glycosides / Flavonoid-3-O-glycosides
|
2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2R,3S,4S,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxymethyl]oxan-2-yl]oxychromen-4-one
|
125528541 |
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)O
|
610.50 |
unknown |
https://doi.org/10.1016/S0031-9422(00)94288-2 |
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 |
https://doi.org/10.1007/BF00597667 |
Rutin
|
5280805 |
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)O
|
610.50 |
unknown |
https://doi.org/10.1007/0-387-28822-8_5 |
> Phenylpropanoids and polyketides / Flavonoids / O-methylated flavonoids / 4-O-methylated flavonoids
|
[5-Hydroxy-2-(3-hydroxy-4-methoxyphenyl)-4-oxo-3-sulfonatooxychromen-7-yl] sulfate
|
21676171 |
Click to see
COC1=C(C=C(C=C1)C2=C(C(=O)C3=C(C=C(C=C3O2)OS(=O)(=O)[O-])O)OS(=O)(=O)[O-])O
|
474.40 |
unknown |
via CMAUP database |